> Acetylides
|
1-Hexadecyne
|
12396 |
Click to see
CCCCCCCCCCCCCCC#C
|
222.41 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
|
2-Methylbutyl benzoate
|
103653 |
Click to see
CCC(C)COC(=O)C1=CC=CC=C1
|
192.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Benzyl Benzoate
|
2345 |
Click to see
C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2
|
212.24 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Butyl Benzoate
|
8698 |
Click to see
CCCCOC(=O)C1=CC=CC=C1
|
178.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hexyl benzoate
|
23235 |
Click to see
CCCCCCOC(=O)C1=CC=CC=C1
|
206.28 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Isopentyl benzoate
|
7193 |
Click to see
CC(C)CCOC(=O)C1=CC=CC=C1
|
192.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Phenethyl benzoate
|
7194 |
Click to see
C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2
|
226.27 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters
|
Methyl Salicylate
|
4133 |
Click to see
COC(=O)C1=CC=CC=C1O
|
152.15 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
|
[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(3,4,5-triacetyloxybenzoyl)oxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162877132 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C4=CC(=C(C(=C4)OC(=O)C)OC(=O)C)OC(=O)C
|
1098.90 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(4-acetyloxybenzoyl)oxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162942723 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C3=CC=C(C=C3)OC(=O)C)COC(=O)C4=CC(=C(C(=C4)OC(=O)C)OC(=O)C)OC(=O)C
|
982.80 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[(2R,3R,4R,5R)-3,4,5-triacetyloxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162987386 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C
|
862.70 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[(2R,3R,4R,5R)-4,5-diacetyloxy-3-hydroxy-2-(3,4,5-triacetyloxybenzoyl)oxyoxan-3-yl]methyl 3,4,5-triacetyloxybenzoate
|
162921526 |
Click to see
CC(=O)OC1COC(C(C1OC(=O)C)(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)O)OC(=O)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C
|
820.70 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[(2R,3R,4R,5S)-3,4-diacetyloxy-5-(4-acetyloxybenzoyl)oxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162942722 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C3=CC=C(C=C3)OC(=O)C)COC(=O)C4=CC(=C(C(=C4)OC(=O)C)OC(=O)C)OC(=O)C
|
982.80 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[(2R,3R,4R,5S)-3,4,5-triacetyloxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162987387 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C
|
862.70 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[3,4-Diacetyloxy-5-(3,4,5-triacetyloxybenzoyl)oxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162877131 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C4=CC(=C(C(=C4)OC(=O)C)OC(=O)C)OC(=O)C
|
1098.90 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[3,4-Diacetyloxy-5-(4-acetyloxybenzoyl)oxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162942721 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C3=CC=C(C=C3)OC(=O)C)COC(=O)C4=CC(=C(C(=C4)OC(=O)C)OC(=O)C)OC(=O)C
|
982.80 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[3,4,5-Triacetyloxy-4-[(3,4,5-triacetyloxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-triacetyloxybenzoate
|
162987385 |
Click to see
CC(=O)OC1C(OC(C1(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C
|
862.70 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
[4,5-Diacetyloxy-3-hydroxy-2-(3,4,5-triacetyloxybenzoyl)oxyoxan-3-yl]methyl 3,4,5-triacetyloxybenzoate
|
162921525 |
Click to see
CC(=O)OC1COC(C(C1OC(=O)C)(COC(=O)C2=CC(=C(C(=C2)OC(=O)C)OC(=O)C)OC(=O)C)O)OC(=O)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C
|
820.70 |
unknown |
https://doi.org/10.1055/S-2006-959533 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids
|
Gallic Acid
|
370 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)O
|
170.12 |
unknown |
https://doi.org/10.1055/S-2006-962499 https://doi.org/10.1007/BF02323304 https://doi.org/10.1016/S0021-9673(01)87884-5 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Galloyl esters
|
[(2R,3R,4R,5R)-4,5-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-4-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-trihydroxybenzoate
|
102157672 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
|
636.50 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
2-C-((Galloyloxy)methyl)-D-ribose 5-gallate
|
21145076 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC(C(C(COC(=O)C2=CC(=C(C(=C2)O)O)O)(C=O)O)O)O
|
484.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
3-O-Galloylhamamelitannin
|
13270020 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
|
636.50 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
5-O-(3,4,5-Trihydroxybenzoyl)-2-C-{[(3,4,5-trihydroxybenzoyl)oxy]methyl}pentose
|
3081370 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC(C(C(COC(=O)C2=CC(=C(C(=C2)O)O)O)(C=O)O)O)O
|
484.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
CID 16211077
|
16211077 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O
|
484.40 |
unknown |
https://doi.org/10.1016/S0031-9422(03)00104-3 https://doi.org/10.1002/PTR.904 https://doi.org/10.1016/0031-9422(96)00926-0 https://doi.org/10.1016/S0041-0101(01)00195-7 https://doi.org/10.1055/S-2006-962499 https://doi.org/10.1007/BF02323304 |
Hamamelitannin
|
253775 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O
|
484.40 |
unknown |
https://doi.org/10.1016/S0031-9422(03)00104-3 |
Hamamelofuranose 2'5'-digallate
|
44584241 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)OCC2C(C(C(O2)O)(COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O
|
484.40 |
unknown |
https://doi.org/10.1002/PTR.904 https://doi.org/10.1016/0031-9422(96)00926-0 https://doi.org/10.1016/S0041-0101(01)00195-7 https://doi.org/10.1055/S-2006-962499 https://doi.org/10.1007/BF02323304 |
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
|
Methyleugenol
|
7127 |
Click to see
COC1=C(C=C(C=C1)CC=C)OC
|
178.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes
|
Phenylacetaldehyde
|
998 |
Click to see
C1=CC=C(C=C1)CC=O
|
120.15 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
|
2-(4-Methylphenyl)propan-2-ol
|
14529 |
Click to see
CC1=CC=C(C=C1)C(C)(C)O
|
150.22 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
6-Methyl-5-(3-methylphenyl)heptan-2-one
|
71410605 |
Click to see
CC1=CC(=CC=C1)C(CCC(=O)C)C(C)C
|
218.33 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Benzenoids / Phenol ethers / Anisoles
|
Anethole
|
637563 |
Click to see
CC=CC1=CC=C(C=C1)OC
|
148.20 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Estragole
|
8815 |
Click to see
COC1=CC=C(C=C1)CC=C
|
148.20 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Benzenoids / Phenols / Benzenetriols and derivatives / Pyrogallols and derivatives / 5-unsubstituted pyrrogallols
|
Pyrogallol
|
1057 |
Click to see
C1=CC(=C(C(=C1)O)O)O
|
126.11 |
unknown |
https://doi.org/10.1002/1099-1573(200012)14:8<612::AID-PTR677>3.0.CO;2-T |
> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Hydrocarbons / Saturated hydrocarbons
|
3-Methylhexacosane
|
6429542 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC(C)CC
|
380.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
3-Methyloctacosane
|
6430424 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCC(C)CC
|
408.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Hydrocarbons / Saturated hydrocarbons / Alkanes
|
Decane
|
15600 |
Click to see
CCCCCCCCCC
|
142.28 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Docosane
|
12405 |
Click to see
CCCCCCCCCCCCCCCCCCCCCC
|
310.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Dodecane
|
8182 |
Click to see
CCCCCCCCCCCC
|
170.33 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Dotriacontane
|
11008 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
|
450.90 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Eicosane
|
8222 |
Click to see
CCCCCCCCCCCCCCCCCCCC
|
282.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Heneicosane
|
12403 |
Click to see
CCCCCCCCCCCCCCCCCCCCC
|
296.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hentriacontane
|
12410 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
|
436.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Heptacosane
|
11636 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCC
|
380.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Heptadecane
|
12398 |
Click to see
CCCCCCCCCCCCCCCCC
|
240.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hexacosane
|
12407 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCC
|
366.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hexadecane
|
11006 |
Click to see
CCCCCCCCCCCCCCCC
|
226.44 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Nonacosane
|
12409 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
|
408.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Nonadecane
|
12401 |
Click to see
CCCCCCCCCCCCCCCCCCC
|
268.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Nonane
|
8141 |
Click to see
CCCCCCCCC
|
128.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Octacosane
|
12408 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCC
|
394.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Octadecane
|
11635 |
Click to see
CCCCCCCCCCCCCCCCCC
|
254.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Octane
|
356 |
Click to see
CCCCCCCC
|
114.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Pentacosane
|
12406 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCC
|
352.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Pentadecane
|
12391 |
Click to see
CCCCCCCCCCCCCCC
|
212.41 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tetracosane
|
12592 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC
|
338.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tetradecane
|
12389 |
Click to see
CCCCCCCCCCCCCC
|
198.39 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tetratriacontane
|
26519 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
|
478.90 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Triacontane
|
12535 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
|
422.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tricosane
|
12534 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCC
|
324.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tridecane
|
12388 |
Click to see
CCCCCCCCCCCCC
|
184.36 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tritriacontane
|
12411 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
|
464.90 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Undecane
|
14257 |
Click to see
CCCCCCCCCCC
|
156.31 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes
|
2-Methyldocosane
|
519145 |
Click to see
CCCCCCCCCCCCCCCCCCCCC(C)C
|
324.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Methylhenicosane
|
528494 |
Click to see
CCCCCCCCCCCCCCCCCCCC(C)C
|
310.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Methylhexacosane
|
150931 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCC(C)C
|
380.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Methyloctacosane
|
519147 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C
|
408.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Methylpentacosane
|
526118 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC(C)C
|
366.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Methyltriacontane
|
73796 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C
|
436.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
3-Methylheneicosane
|
522120 |
Click to see
CCCCCCCCCCCCCCCCCCC(C)CC
|
310.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
3-Methylheptacosane
|
85690 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCC(C)CC
|
394.80 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
3-Methylpentacosane
|
189001 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCC(C)CC
|
366.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
3-Methyltetradecane
|
86735 |
Click to see
CCCCCCCCCCCC(C)CC
|
212.41 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
4-Methylpentacosane
|
526120 |
Click to see
CCCCCCCCCCCCCCCCCCCCCC(C)CCC
|
366.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
4-Methyltetracosane
|
527470 |
Click to see
CCCCCCCCCCCCCCCCCCCCC(C)CCC
|
352.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
5-Methyltricosane
|
519937 |
Click to see
CCCCCCCCCCCCCCCCCCC(C)CCCC
|
338.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Hydrocarbons / Unsaturated hydrocarbons / Olefins / Acyclic olefins / Alkadienes
|
Heptadecadiene
|
6365522 |
Click to see
CCCCCCCCCCCCCC=CC=C
|
236.40 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
n-Heptadecadiene
|
3016864 |
Click to see
CCCCCCCCCCCCCC=CC=C
|
236.40 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons
|
1-Docosene
|
74138 |
Click to see
CCCCCCCCCCCCCCCCCCCCC=C
|
308.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Heneicosene
|
3015374 |
Click to see
CCCCCCCCCCCCCCCCCCCC=C
|
294.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Heptadecene
|
23217 |
Click to see
CCCCCCCCCCCCCCCC=C
|
238.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Hexacosene
|
29303 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCC=C
|
364.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Nonadecene
|
29075 |
Click to see
CCCCCCCCCCCCCCCCCC=C
|
266.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Octadecene
|
8217 |
Click to see
CCCCCCCCCCCCCCCCC=C
|
252.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Tetracosene
|
82436 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCC=C
|
336.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
|
Ethyl Myristate
|
31283 |
Click to see
CCCCCCCCCCCCCC(=O)OCC
|
256.42 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Ethyl Oleate
|
5363269 |
Click to see
CCCCCCCCC=CCCCCCCCC(=O)OCC
|
310.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Ethyl palmitate
|
12366 |
Click to see
CCCCCCCCCCCCCCCC(=O)OCC
|
284.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Ethyl tetracosanoate
|
141135 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC
|
396.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hexyl tiglate
|
637523 |
Click to see
CCCCCCOC(=O)C(=CC)C
|
184.27 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
|
Methyl arachidate
|
14259 |
Click to see
CCCCCCCCCCCCCCCCCCCC(=O)OC
|
326.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl behenate
|
13584 |
Click to see
CCCCCCCCCCCCCCCCCCCCCC(=O)OC
|
354.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl oleate
|
5364509 |
Click to see
CCCCCCCCC=CCCCCCCCC(=O)OC
|
296.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl palmitate
|
8181 |
Click to see
CCCCCCCCCCCCCCCC(=O)OC
|
270.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl tetracosanoate
|
75546 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC
|
382.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl Tetradecanoate
|
31284 |
Click to see
CCCCCCCCCCCCCC(=O)OC
|
242.40 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
|
Palmitic Acid
|
985 |
Click to see
CCCCCCCCCCCCCCCC(=O)O
|
256.42 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
|
Nonanoic Acid
|
8158 |
Click to see
CCCCCCCCC(=O)O
|
158.24 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
|
Geranyl formate
|
5282109 |
Click to see
CC(=CCCC(=CCOC=O)C)C
|
182.26 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
|
1-Heptanol
|
8129 |
Click to see
CCCCCCCO
|
116.20 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Hexanol
|
8103 |
Click to see
CCCCCCO
|
102.17 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Octanol
|
957 |
Click to see
CCCCCCCCO
|
130.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Octen-3-Ol
|
18827 |
Click to see
CCCCCC(C=C)O
|
128.21 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
3-Octanol
|
11527 |
Click to see
CCCCCC(CC)O
|
130.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Docosanol
|
12620 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCO
|
326.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Nonan-1-ol
|
8914 |
Click to see
CCCCCCCCCO
|
144.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols
|
1-Eicosanol
|
12404 |
Click to see
CCCCCCCCCCCCCCCCCCCCO
|
298.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
1-Pentadecanol
|
12397 |
Click to see
CCCCCCCCCCCCCCCO
|
228.41 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Cetyl Alcohol
|
2682 |
Click to see
CCCCCCCCCCCCCCCCO
|
242.44 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Stearyl Alcohol
|
8221 |
Click to see
CCCCCCCCCCCCCCCCCCO
|
270.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes
|
Docosanal
|
3017068 |
Click to see
CCCCCCCCCCCCCCCCCCCCCC=O
|
324.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Heneicosanal
|
12052911 |
Click to see
CCCCCCCCCCCCCCCCCCCCC=O
|
310.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hexacosanal
|
3084462 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCC=O
|
380.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hexadecanal
|
984 |
Click to see
CCCCCCCCCCCCCCCC=O
|
240.42 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Icosanal
|
75458 |
Click to see
CCCCCCCCCCCCCCCCCCCC=O
|
296.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Nonadecanal
|
176926 |
Click to see
CCCCCCCCCCCCCCCCCCC=O
|
282.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Octacosanal
|
3084376 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCCCC=O
|
408.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Pentadecanal
|
17697 |
Click to see
CCCCCCCCCCCCCCC=O
|
226.40 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tetracosanal
|
557529 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC=O
|
352.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tetradecanal
|
31291 |
Click to see
CCCCCCCCCCCCCC=O
|
212.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Tridecanal
|
25311 |
Click to see
CCCCCCCCCCCCC=O
|
198.34 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
|
Ethyl Linoleate
|
5282184 |
Click to see
CCCCCC=CCC=CCCCCCCCC(=O)OCC
|
308.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl elaidolinolenate
|
5367462 |
Click to see
CCC=CCC=CCC=CCCCCCCCC(=O)OC
|
292.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl linoleate
|
5284421 |
Click to see
CCCCCC=CCC=CCCCCCCCC(=O)OC
|
294.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Methyl linolenate
|
5319706 |
Click to see
CCC=CCC=CCC=CCCCCCCCC(=O)OC
|
292.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
Manool
|
3034394 |
Click to see
CC1(CCCC2(C1CCC(=C)C2CCC(C)(C=C)O)C)C
|
290.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
|
Isophytol
|
10453 |
Click to see
CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O
|
296.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Phytol
|
5280435 |
Click to see
CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C
|
296.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
|
(1S,9R,13S)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane
|
91746569 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C
|
272.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Kaur-16-ene
|
520687 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C
|
272.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
Geraniol
|
637566 |
Click to see
CC(=CCCC(=CCO)C)C
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Geranylacetone
|
1549778 |
Click to see
CC(=CCCC(=CCCC(=O)C)C)C
|
194.31 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Linalool, (+/-)-
|
6549 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Nerol
|
643820 |
Click to see
CC(=CCCC(=CCO)C)C
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(+)-Isoborneol
|
6973640 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
(1S,3R,5S)-6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptan-3-ol
|
12314318 |
Click to see
CC1(C2CC1C(=C)C(C2)O)C
|
152.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
alpha-CIS-BERGAMOTENE
|
6429303 |
Click to see
CC1=CCC2CC1C2(C)CCC=C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Myrtenol
|
10582 |
Click to see
CC1(C2CC=C(C1C2)CO)C
|
152.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Pinocarveol
|
102667 |
Click to see
CC1(C2CC1C(=C)C(C2)O)C
|
152.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
4-Terpineol, (+/-)-
|
11230 |
Click to see
CC1=CCC(CC1)(C(C)C)O
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Alpha-Terpineol
|
17100 |
Click to see
CC1=CCC(CC1)C(C)(C)O
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(+)-delta-Cadinene
|
441005 |
Click to see
CC1=CC2C(CCC(=C2CC1)C)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
(1S,2S,6S,7R,8R)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene
|
101607926 |
Click to see
CC1=CCC2C3C1C2(CCC3C(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 https://doi.org/10.1055/S-2006-957420 |
(R)-beta-bisabolene
|
68128 |
Click to see
CC1=CCC(CC1)C(=C)CCC=C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
3,4-Dihydrocadalene
|
528708 |
Click to see
CC1=CCC(C2=C1C=CC(=C2)C)C(C)C
|
200.32 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
6-Methyl-2-(4-methylphenyl)hept-5-en-2-ol
|
185199 |
Click to see
CC1=CC=C(C=C1)C(C)(CCC=C(C)C)O
|
218.33 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
alpha-Calacorene
|
12302243 |
Click to see
CC1=CCC(C2=C1C=CC(=C2)C)C(C)C
|
200.32 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
alpha-Curcumene
|
92139 |
Click to see
CC1=CC=C(C=C1)C(C)CCC=C(C)C
|
202.33 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Alpha-Farnesene
|
5281516 |
Click to see
CC(=CCCC(=CCC=C(C)C=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
ar-Turmerone
|
160512 |
Click to see
CC1=CC=C(C=C1)C(C)CC(=O)C=C(C)C
|
216.32 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Beta-Bisabolene
|
10104370 |
Click to see
CC1=CCC(CC1)C(=C)CCC=C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
beta-Calacorene
|
529621 |
Click to see
CC1=CC2=C(C=C1)C(=C)CCC2C(C)C
|
200.32 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
beta-Farnesene
|
5281517 |
Click to see
CC(=CCCC(=CCCC(=C)C=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
beta-Ionone
|
638014 |
Click to see
CC1=C(C(CCC1)(C)C)C=CC(=O)C
|
192.30 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
beta-Santalene
|
10889018 |
Click to see
CC(=CCCC1(C2CCC(C2)C1=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Cadalene
|
10225 |
Click to see
CC1=CC2=C(C=CC(=C2C=C1)C)C(C)C
|
198.30 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Cadina-1(10),4-diene
|
10223 |
Click to see
CC1=CC2C(CCC(=C2CC1)C)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Cyclosativene
|
519960 |
Click to see
CC(C)C1CCC2(C3C1C4C2(C4C3)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
gamma-Bisabolene, (Z)-
|
3033866 |
Click to see
CC1=CCC(=C(C)CCC=C(C)C)CC1
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Humulene
|
5281520 |
Click to see
CC1=CCC(C=CCC(=CCC1)C)(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Norbornane, 2-methyl-3-methylene-2-(4-methyl-3-pentenyl)-
|
10534 |
Click to see
CC(=CCCC1(C2CCC(C2)C1=C)C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
T-Muurolol
|
3084331 |
Click to see
CC1=CC2C(CCC(C2CC1)(C)O)C(C)C
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
trans-Nerolidol
|
5284507 |
Click to see
CC(=CCCC(=CCCC(C)(C=C)O)C)C
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
|
Ledum camphor
|
22297324 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2(C)O
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Viridiflorol
|
11996452 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2(C)O
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Viridiflorol (incomplete stereochemistry)
|
94174 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2(C)O
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
|
alpha-Eudesmol
|
92762 |
Click to see
CC1=CCCC2(C1CC(CC2)C(C)(C)O)C
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
gamma-EUDESMOL
|
6432005 |
Click to see
CC1=C2CC(CCC2(CCC1)C)C(C)(C)O
|
222.37 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
|
(S,1Z,6Z)-8-Isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene
|
91723653 |
Click to see
CC1=CCCC(=C)C=CC(CC1)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Germacrene D
|
5317570 |
Click to see
CC1=CCCC(=C)C=CC(CC1)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Himachalane and lippifoliane sesquiterpenoids
|
(-)-alpha-Himachalene
|
11830551 |
Click to see
CC1=CC2C(CC1)C(=C)CCCC2(C)C
|
204.35 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
3-ethenyl-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromene
|
518574 |
Click to see
CC1(CCCC2(C1CCC3(C2CCC(O3)(C)C=C)C)C)C
|
290.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Squalene
|
638072 |
Click to see
CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C
|
410.70 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tetracarboxylic acids and derivatives
|
[(2R,3R,4R,5S)-4-hydroxy-5-(4-hydroxybenzoyl)oxy-3-(3,4,5-trihydroxybenzoyl)oxy-4-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-trihydroxybenzoate
|
10533134 |
Click to see
C1=CC(=CC=C1C(=O)OC2C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)(COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O
|
756.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
[4-Hydroxy-5-(4-hydroxybenzoyl)oxy-3-(3,4,5-trihydroxybenzoyl)oxy-4-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxolan-2-yl]methyl 3,4,5-trihydroxybenzoate
|
85175321 |
Click to see
C1=CC(=CC=C1C(=O)OC2C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)(COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O
|
756.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
|
3-{[3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid
|
348159 |
Click to see
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
|
354.31 |
unknown |
https://doi.org/10.1007/BF02323304 |
Chlorogenic Acid
|
1794427 |
Click to see
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
|
354.31 |
unknown |
https://doi.org/10.1007/BF02323304 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
|
Hotrienol
|
5366264 |
Click to see
CC(=C)C=CCC(C)(C=C)O
|
152.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Myrcenol
|
10975 |
Click to see
CC(C)(CCCC(=C)C=C)O
|
154.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
2-(4-Hydroxyphenoxy)-6-[3-(4-hydroxyphenyl)prop-2-enoxymethyl]oxane-3,4,5-triol
|
162890773 |
Click to see
C1=CC(=CC=C1C=CCOCC2C(C(C(C(O2)OC3=CC=C(C=C3)O)O)O)O)O
|
404.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
|
Decanal
|
8175 |
Click to see
CCCCCCCCCC=O
|
156.26 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Dodecanal
|
8194 |
Click to see
CCCCCCCCCCCC=O
|
184.32 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Nonanal
|
31289 |
Click to see
CCCCCCCCC=O
|
142.24 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Octanal
|
454 |
Click to see
CCCCCCCC=O
|
128.21 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Undecanal
|
8186 |
Click to see
CCCCCCCCCCC=O
|
170.29 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
|
6-Methyl-3,5-heptadien-2-one
|
5370101 |
Click to see
CC(=CC=CC(=O)C)C
|
124.18 |
unknown |
https://doi.org/10.1055/S-0028-1100019 |
6-Methyl-3,5-heptadienon
|
27971 |
Click to see
CC(=CC=CC(=O)C)C
|
124.18 |
unknown |
https://doi.org/10.1055/S-0028-1100019 |
Damascenone
|
5366074 |
Click to see
CC=CC(=O)C1=C(C=CCC1(C)C)C
|
190.28 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
|
2-Eicosanone
|
13592265 |
Click to see
CCCCCCCCCCCCCCCCCCC(=O)C
|
296.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Heneicosanone
|
529805 |
Click to see
CCCCCCCCCCCCCCCCCCCC(=O)C
|
310.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Heptadecanone
|
18027 |
Click to see
CCCCCCCCCCCCCCCC(=O)C
|
254.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Nonadecanone
|
69423 |
Click to see
CCCCCCCCCCCCCCCCCC(=O)C
|
282.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Octadecanone
|
81844 |
Click to see
CCCCCCCCCCCCCCCCC(=O)C
|
268.50 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Pentadecanone
|
61303 |
Click to see
CCCCCCCCCCCCCC(=O)C
|
226.40 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Tricosanone
|
529806 |
Click to see
CCCCCCCCCCCCCCCCCCCCCC(=O)C
|
338.60 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Tridecanone
|
11622 |
Click to see
CCCCCCCCCCCC(=O)C
|
198.34 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
2-Undecanone
|
8163 |
Click to see
CCCCCCCCCC(=O)C
|
170.29 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Hexadecan-2-one
|
29251 |
Click to see
CCCCCCCCCCCCCCC(=O)C
|
240.42 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organoheterocyclic compounds / Epoxides
|
2,3-Epoxy-3,7-dimethyloct-6-enol
|
530403 |
Click to see
CC(=CCCC1(C(O1)CO)C)C
|
170.25 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
|
(S)-4-Nonanolide
|
441574 |
Click to see
CCCCCC1CCC(=O)O1
|
156.22 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
Gamma-nonalactone
|
7710 |
Click to see
CCCCCC1CCC(=O)O1
|
156.22 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organoheterocyclic compounds / Oxolanes
|
cis-Vitispirane
|
91748031 |
Click to see
CC1CCC2(O1)C(=C)C=CCC2(C)C
|
192.30 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organoheterocyclic compounds / Pyrans
|
Nerol oxide
|
61275 |
Click to see
CC1=CCOC(C1)C=C(C)C
|
152.23 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Organoheterocyclic compounds / Tetrahydrofurans
|
Vitispirane A
|
15624540 |
Click to see
CC1CCC2(O1)C(=C)C=CCC2(C)C
|
192.30 |
unknown |
https://doi.org/10.1055/S-2006-957420 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
|
3,4-Dihydroxy cinnamic acid
|
2518 |
Click to see
C1=CC(=C(C=C1C=CC(=O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF02323304 |
Caffeic Acid
|
689043 |
Click to see
C1=CC(=C(C=C1C=CC(=O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/BF02323304 |
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
|
(2R,2'R)-2alpha-(3,4,5-Trihydroxyphenyl)-2'alpha-(3,4-dihydroxyphenyl)-3alpha-(galloyloxy)-4beta,8'-bichroman-3'beta,5,5',7,7'-pentol
|
13831071 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O
|
746.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
(2R,2'R)-2alpha-(3,4,5-Trihydroxyphenyl)-2'alpha-(3,4-dihydroxyphenyl)-4beta,8'-bichroman-3alpha,3'beta,5,5',7,7'-hexol
|
13831060 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
[(2R,3R,4R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4-[(2R,3S)-3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
|
15813248 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C(=C7)O)O)O)O
|
762.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
[(2R,3S)-2-(3,4-dihydroxyphenyl)-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 4-hydroxybenzoate
|
10676182 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)OC(=O)C7=CC=C(C=C7)O
|
698.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
[2-(3,4-dihydroxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 4-hydroxybenzoate
|
85229060 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)OC(=O)C7=CC=C(C=C7)O
|
698.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
[4-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
|
13831072 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O
|
746.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
[5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4-[3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-8-yl]-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
|
73834037 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C(=C7)O)O)O)O
|
762.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
2-(3,4-dihydroxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
|
130556 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
|
578.50 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
ent-Epicatechin-(4alpha->8)-ent-epicatechin 3-gallate
|
12795889 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O
|
730.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
Epigallocatechin-(4beta->8)-catechin
|
13831061 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C(=C5)O)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
Proanthocyanidin
|
108065 |
Click to see
COC1=C(C=C(C=C1O)C2C(CC3=C(O2)C(=C(C=C3O)O)C4C(C(OC5=CC(=CC(=C45)O)O)C6=CC=C(C=C6)O)O)O)O
|
592.50 |
unknown |
https://doi.org/10.1016/S0031-9422(03)00104-3 |
procyanidin B1 3-O-gallate
|
12795888 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O)O)O)C7=CC(=C(C=C7)O)O)O
|
730.60 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
Procyanidin B3
|
146798 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
|
578.50 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
|
(2R,3R,4S)-2-(3,4-dihydroxyphenyl)-2-[[(2S,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy]-3,4-dihydrochromene-3,4,5,7-tetrol
|
122173182 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC4(C(C(C5=C(C=C(C=C5O4)O)O)O)O)C6=CC(=C(C=C6)O)O
|
594.50 |
unknown |
https://doi.org/10.1016/S0031-9422(03)00104-3 |
2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol
|
1203 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
https://doi.org/10.1007/BF02323304 https://doi.org/10.1016/S0031-9422(03)00104-3 |
Cianidanol
|
9064 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 https://doi.org/10.1016/S0031-9422(03)00104-3 https://doi.org/10.1007/BF02323304 |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Epigallocatechins
|
Gallocatechin
|
65084 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O
|
306.27 |
unknown |
https://doi.org/10.1016/0031-9422(96)00926-0 |
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
|
Kaempferol
|
5280863 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O
|
286.24 |
unknown |
https://doi.org/10.1007/BF02323304 |
Quercetin
|
5280343 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O
|
302.23 |
unknown |
https://doi.org/10.1007/BF02323304 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-3-O-glucuronides
|
(2S,3S,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
|
44259219 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O
|
478.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
Kaempferol 3-glucuronide
|
5318759 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O
|
462.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
Kaempferol-3-O-glucuronoside
|
14185731 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O
|
462.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
Quercetin 3-glucuronide
|
12004528 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O
|
478.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
Querciturone
|
5274585 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O
|
478.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
5378597 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
5462193 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
Hyperoside
|
5281643 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
Trifolin
|
5282149 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1007/BF02323304 |
> Phenylpropanoids and polyketides / Flavonoids / Hydroxyflavonoids / 7-hydroxyflavonoids
|
Cyanidin
|
128861 |
Click to see
C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O)O
|
287.24 |
unknown |
https://doi.org/10.1007/BF02323304 |
Flavylium, 3,3',4',5,5',7-hexahydroxy-
|
128853 |
Click to see
C1=C(C=C(C(=C1O)O)O)C2=[O+]C3=CC(=CC(=C3C=C2O)O)O
|
303.24 |
unknown |
https://doi.org/10.1007/BF02323304 |