> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
|
(1S,4Z,8R)-5,9,9-trimethyl-2-methylidenebicyclo[6.2.0]dec-4-ene
|
18502770 |
Click to see
CC1=CCC(=C)C2CC(C2CC1)(C)C
|
190.32 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Dibenzylbutane lignans / Dibenzylbutanediol lignans
|
Secoisolariciresinol
|
65373 |
Click to see
COC1=C(C=CC(=C1)CC(CO)C(CC2=CC(=C(C=C2)O)OC)CO)O
|
362.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Lignans, neolignans and related compounds / Furanoid lignans
|
(+)-Sesamin dicatechol
|
46881231 |
Click to see
C1C2C(COC2C3=CC(=C(C=C3)O)O)C(O1)C4=CC(=C(C=C4)O)O
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-[(3S,3aR,6S,6aR)-6-[(2R,3S)-3-(3,4-dihydroxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]benzene-1,2-diol
|
162991129 |
Click to see
C1C2C(COC2C3=CC4=C(C=C3)OC(C(O4)C5=CC(=C(C=C5)O)O)CO)C(O1)C6=CC(=C(C=C6)O)O
|
494.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-[6-[2-(3,4-Dihydroxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]benzene-1,2-diol
|
74963247 |
Click to see
C1C2C(COC2C3=CC4=C(C=C3)OC(C(O4)CO)C5=CC(=C(C=C5)O)O)C(O1)C6=CC(=C(C=C6)O)O
|
494.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-[6-[3-(3,4-Dihydroxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]benzene-1,2-diol
|
74963248 |
Click to see
C1C2C(COC2C3=CC4=C(C=C3)OC(C(O4)C5=CC(=C(C=C5)O)O)CO)C(O1)C6=CC(=C(C=C6)O)O
|
494.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
Proncipin
|
46186848 |
Click to see
C1C2C(COC2C3=CC4=C(C=C3)OC(C(O4)C5=CC(=C(C=C5)O)O)CO)C(O1)C6=CC(=C(C=C6)O)O
|
494.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
Syringaresinol
|
100067 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
Syringaresinol, (+)-
|
443023 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Lignans, neolignans and related compounds / Lignan glycosides
|
(+)-Lyoniresinol 9-glucoside
|
74256819 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C(C(CC3=CC(=C(C(=C23)OC)O)OC)COC4C(C(C(C(O4)CO)O)O)O)CO
|
582.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2R,3R,4S,5S,6R)-2-[(2R,3S)-4-hydroxy-2,3-bis[(4-hydroxy-3,5-dimethoxyphenyl)methyl]butoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
135686664 |
Click to see
COC1=CC(=CC(=C1O)OC)CC(CO)C(CC2=CC(=C(C(=C2)OC)O)OC)COC3C(C(C(C(O3)CO)O)O)O
|
584.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2R,3R,4S,5S,6R)-2-[[(2R,3R,4S)-6-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-5,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
71716979 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C(C(CC3=CC(=C(C(=C23)OC)O)OC)COC4C(C(C(C(O4)CO)O)O)O)CO
|
582.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2R,3R,4S,5S,6R)-2-[[(2S,3R,4R)-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
163070004 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C(C(CO2)CC3=CC(=C(C=C3)O)OC)COC4C(C(C(C(O4)CO)O)O)O
|
552.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2R,3R,4S,5S,6R)-2-[[(2S,3R,4R)-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-3-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
155528232 |
Click to see
COC1=CC(=CC(=C1O)OC)CC2COC(C2COC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C(=C4)OC)O)OC
|
582.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2S,3R,4S,5S,6R)-2-[(3R,4R,5S)-5-(4-hydroxy-3-methoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-4-(hydroxymethyl)oxolan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
163049907 |
Click to see
COC1=C(C=CC(=C1)CC2(COC(C2CO)C3=CC(=C(C=C3)O)OC)OC4C(C(C(C(O4)CO)O)O)O)O
|
538.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2S,3R,4S,5S,6R)-2-[(3R,4R,5S)-5-(4-hydroxy-3,5-dimethoxyphenyl)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-(hydroxymethyl)oxolan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
163187144 |
Click to see
COC1=CC(=CC(=C1O)OC)CC2(COC(C2CO)C3=CC(=C(C(=C3)OC)O)OC)OC4C(C(C(C(O4)CO)O)O)O
|
598.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2S,3R,4S,5S,6R)-2-[4-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
486614 |
Click to see
COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)OC5C(C(C(C(O5)CO)O)O)O)OC)O
|
520.50 |
unknown |
via CMAUP database |
2-[[2-(4-Hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
163070003 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C(C(CO2)CC3=CC(=C(C=C3)O)OC)COC4C(C(C(C(O4)CO)O)O)O
|
552.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-[[2-(4-Hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-3-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
162887826 |
Click to see
COC1=CC(=CC(=C1O)OC)CC2COC(C2COC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C(=C4)OC)O)OC
|
582.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-[4-Hydroxy-2,3-bis[(4-hydroxy-3,5-dimethoxyphenyl)methyl]butoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
74105562 |
Click to see
COC1=CC(=CC(=C1O)OC)CC(CO)C(CC2=CC(=C(C(=C2)OC)O)OC)COC3C(C(C(C(O3)CO)O)O)O
|
584.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-[5-(4-Hydroxy-3-methoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-4-(hydroxymethyl)oxolan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
163049906 |
Click to see
COC1=C(C=CC(=C1)CC2(COC(C2CO)C3=CC(=C(C=C3)O)OC)OC4C(C(C(C(O4)CO)O)O)O)O
|
538.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-[5-(4-Hydroxy-3,5-dimethoxyphenyl)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-4-(hydroxymethyl)oxolan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
162844606 |
Click to see
COC1=CC(=CC(=C1O)OC)CC2(COC(C2CO)C3=CC(=C(C(=C3)OC)O)OC)OC4C(C(C(C(O4)CO)O)O)O
|
598.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
4,4'-[(2S,3S)-2-(Hydroxymethyl)-3-(beta-D-glucopyranosyloxymethyl)-1,4-butanediyl]bis(2,6-dimethoxyphenol)
|
10438279 |
Click to see
COC1=CC(=CC(=C1O)OC)CC(CO)C(CC2=CC(=C(C(=C2)OC)O)OC)COC3C(C(C(C(O3)CO)O)O)O
|
584.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
Acanthoside B
|
443024 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)OC5C(C(C(C(O5)CO)O)O)O)OC
|
580.60 |
unknown |
via CMAUP database |
Eucommin A
|
442836 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C3C4COC(C4CO3)C5=CC(=C(C=C5)O)OC
|
550.60 |
unknown |
via CMAUP database |
Isoeucommin A
|
44206182 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C=C4)OC5C(C(C(C(O5)CO)O)O)O)OC
|
550.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
|
(1R,5R,8S)-8-hydroxy-1,5-dimethyl-8-[(E,3S)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]-6-oxabicyclo[3.2.1]octan-3-one
|
102158225 |
Click to see
CC(C=CC1(C2(CC(=O)CC1(OC2)C)C)O)OC3C(C(C(C(O3)CO)O)O)O
|
402.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-hydroxy-3,5,5-trimethyl-4-[(E,3R)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one
|
6325925 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-Hydroxy-3,5,5-trimethyl-4-[3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]cyclohex-2-en-1-one
|
73815023 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
8-Hydroxy-1,5-dimethyl-8-[3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-1-enyl]-6-oxabicyclo[3.2.1]octan-3-one
|
73157302 |
Click to see
CC(C=CC1(C2(CC(=O)CC1(OC2)C)C)O)OC3C(C(C(C(O3)CO)O)O)O
|
402.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
Roseoside
|
9930064 |
Click to see
CC1=CC(=O)CC(C1(C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
Spionoside B
|
46881259 |
Click to see
CC(C=CC1(C2(CC(=O)CC1(OC2)C)C)O)OC3C(C(C(C(O3)CO)O)O)O
|
402.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(+)-alpha-Pinene
|
82227 |
Click to see
CC1=CCC2CC1C2(C)C
|
136.23 |
unknown |
via CMAUP database |
(+)-Isoborneol
|
6973640 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
via CMAUP database |
Borneol
|
6552009 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
via CMAUP database |
Isoborneol
|
6321405 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
via CMAUP database |
Humulene
|
5281520 |
Click to see
CC1=CCC(C=CCC(=CCC1)C)(C)C
|
204.35 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
|
Beta-Elemene
|
6918391 |
Click to see
CC(=C)C1CCC(C(C1)C(=C)C)(C)C=C
|
204.35 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
|
(2R,3R,4S,5S,6R)-2-[(1R,6S)-6-hydroxy-3-[(E,3R)-3-hydroxybut-1-enyl]-2,4,4-trimethylcyclohex-2-en-1-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
163038220 |
Click to see
CC1=C(C(CC(C1OC2C(C(C(C(O2)CO)O)O)O)O)(C)C)C=CC(C)O
|
388.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
CID 15628135
|
15628135 |
Click to see
CC(=O)C=C=C1C(CC(CC1(C)O)OC2C(C(C(C(O2)CO)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
Icariside B1
|
15628136 |
Click to see
CC(=O)C=C=C1C(CC(CC1(C)O)OC2C(C(C(C(O2)CO)O)O)O)(C)C
|
386.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
|
(5R,8R,9S,10R,13R,14R,17S)-17-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
|
40884713 |
Click to see
CC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC4C5(CCC(O5)C(C)(C)O)C)C)C)C
|
458.70 |
unknown |
via CMAUP database |
Ocotillol I
|
101967086 |
Click to see
CC1(C2CCC3(C(C2(CCC1O)C)CCC4C3(CCC4C5(CCC(O5)C(C)(C)O)C)C)C)C
|
460.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
(1S,2R,4aS,6aR,6aS,6bR,8aS,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid
|
51531959 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)O
|
488.70 |
unknown |
via CMAUP database |
11-Oxoasiatic acid
|
69624247 |
Click to see
CC1CCC2(CCC3(C(=CC(=O)C4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)O
|
502.70 |
unknown |
via CMAUP database |
Alphitolic acid
|
12305768 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC5C4(CC(C(C5(C)C)O)O)C)C)C(=O)O
|
472.70 |
unknown |
via CMAUP database |
Arjunolic acid
|
73641 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1)C)C(=O)O)C
|
488.70 |
unknown |
via CMAUP database |
Asiatic Acid
|
119034 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)O
|
488.70 |
unknown |
via CMAUP database |
Dipterocarpol
|
441676 |
Click to see
CC(=CCCC(C)(C1CCC2(C1CCC3C2(CCC4C3(CCC(=O)C4(C)C)C)C)C)O)C
|
442.70 |
unknown |
via CMAUP database |
Dryobalanone
|
12309393 |
Click to see
CC(=CCCC(CO)(C1CCC2(C1CCC3C2(CCC4C3(CCC(=O)C4(C)C)C)C)C)O)C
|
458.70 |
unknown |
via CMAUP database |
Erythrodiol
|
101761 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)CO)C
|
442.70 |
unknown |
via CMAUP database |
Hederagenin
|
73299 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C
|
472.70 |
unknown |
via CMAUP database |
Maslinic Acid
|
73659 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C
|
472.70 |
unknown |
via CMAUP database |
Methyl oleanonate
|
10695622 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)C)C(=O)OC)C
|
468.70 |
unknown |
via CMAUP database |
Oleanolic Acid
|
10494 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
via CMAUP database |
Oleanonic acid
|
12313704 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)C)C(=O)O)C
|
454.70 |
unknown |
via CMAUP database |
> Nucleosides, nucleotides, and analogues / Purine nucleosides
|
2-(6-Aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
|
191 |
Click to see
C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N
|
267.24 |
unknown |
https://doi.org/10.1021/NP9006298 |
9-alpha-Ribofuranosyladenine
|
448378 |
Click to see
C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N
|
267.24 |
unknown |
https://doi.org/10.1021/NP9006298 |
Adenosine
|
60961 |
Click to see
C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N
|
267.24 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Organic oxygen compounds / Organic hydroperoxides / Allylic hydroperoxides
|
(4S,5E)-4-hydroperoxytrideca-1,5-dien-7,9-diyne
|
162932058 |
Click to see
CCCC#CC#CC=CC(CC=C)OO
|
204.26 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
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(2R,3R,4S,5S,6R)-2-[(1R,2S)-3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-2-[4-[(E)-3-hydroxyprop-1-enyl]-2,6-dimethoxyphenoxy]propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
163186313 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)OC3C(C(C(C(O3)CO)O)O)O)OC)C=CCO
|
568.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
erythro-Guaiacylglycerol |A-sinapyl ether 7-O-glucoside
|
75224289 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)OC3C(C(C(C(O3)CO)O)O)O)OC)C=CCO
|
568.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
erythro-Guaiacylglycerol beta-sinapyl ether 7-O-glucoside
|
46881230 |
Click to see
COC1=CC(=CC(=C1OC(CO)C(C2=CC(=C(C=C2)O)OC)OC3C(C(C(C(O3)CO)O)O)O)OC)C=CCO
|
568.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
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(-)-isocitruscin C
|
46186820 |
Click to see
CCCC1=CC(=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O)OC
|
328.36 |
unknown |
via CMAUP database |
(2S,3R,4S,5R,6R)-2-(4-hydroxy-2-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
|
154496802 |
Click to see
COC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)CO)O)O)O
|
302.28 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2S,3R,4S,5R,6R)-2-(4-hydroxy-3,5-dimethoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
|
160955167 |
Click to see
COC1=CC(=CC(=C1O)OC)OC2C(C(C(C(O2)CO)O)O)O
|
332.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
(2S,3S,4S,5R,6R)-2-(4-hydroxy-3-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
|
159263713 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)O)O
|
302.28 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-(4-Hydroxy-2-methoxyphenoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
|
75080207 |
Click to see
COC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O
|
434.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-(4-Hydroxy-3-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
|
73154502 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)O)O
|
302.28 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-(4-Hydroxy-3-methoxyphenoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
|
51136414 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O)O
|
434.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-(Hydroxymethyl)-6-[4-(hydroxymethyl)-2-methoxyphenoxy]oxane-3,4,5-triol
|
69086659 |
Click to see
COC1=C(C=CC(=C1)CO)OC2C(C(C(C(O2)CO)O)O)O
|
316.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-(Hydroxymethyl)-6-[4-(hydroxymethyl)-2,6-dimethoxyphenoxy]oxane-3,4,5-triol
|
13965334 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)CO
|
346.33 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-Methoxy-4-(6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyloxy)phenol
|
11048334 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O)O
|
434.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-Hydroxy-3,5-dimethoxyphenyl beta-D-glucopyranoside; (-)-3,5-Dimethoxy-4-hydroxyphenyl beta-D-glucopyranoside
|
73981643 |
Click to see
COC1=CC(=CC(=C1O)OC)OC2C(C(C(C(O2)CO)O)O)O
|
332.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
Capparoside A
|
44606077 |
Click to see
COC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O
|
434.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
Di-O-Methylcrenatin
|
10736338 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)CO
|
346.33 |
unknown |
https://doi.org/10.1021/NP9006298 |
Glucopyranoside, 4-hydroxy-2-methoxyphenyl, beta-D-(8CI); 4-Hydroxy-2-methoxyphenyl beta-D-glucopyranoside
|
72744980 |
Click to see
COC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)CO)O)O)O
|
302.28 |
unknown |
https://doi.org/10.1021/NP9006298 |
Isotachioside
|
15098566 |
Click to see
COC1=C(C=CC(=C1)O)OC2C(C(C(C(O2)CO)O)O)O
|
302.28 |
unknown |
https://doi.org/10.1021/NP9006298 |
Koaburaside
|
5318820 |
Click to see
COC1=CC(=CC(=C1O)OC)OC2C(C(C(C(O2)CO)O)O)O
|
332.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
Leonuriside
|
14237626 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)O
|
332.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
Leonuriside A
|
14237625 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)O
|
332.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
Tachioside
|
11962143 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)O)O
|
302.28 |
unknown |
https://doi.org/10.1021/NP9006298 |
Vanilloloside
|
44577222 |
Click to see
COC1=C(C=CC(=C1)CO)OC2C(C(C(C(O2)CO)O)O)O
|
316.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Organoheterocyclic compounds / Azepanes
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(1S,2R,10Z,18R,20S,26Z,29Z,31E,33S,34S,35S)-33,34-dihydroxy-5,22-diazapentacyclo[16.16.1.01,22.02,20.05,35]pentatriaconta-10,26,29,31-tetraene-18-carbaldehyde
|
163186914 |
Click to see
C1CCCC2(CC3CN4CCCC=CCC=CC=CC(C(C45C3CCN(C52)CCCCC=CCC1)O)O)C=O
|
536.80 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Organoheterocyclic compounds / Benzodioxanes / Phenylbenzodioxanes / Phenylbenzo-1,4-dioxanes
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4-[(2S,3S)-2-(hydroxymethyl)-6-[(E)-3-hydroxyprop-1-enyl]-2,3-dihydro-1,4-benzodioxin-3-yl]benzene-1,2-diol
|
76853576 |
Click to see
C1=CC2=C(C=C1C=CCO)OC(C(O2)CO)C3=CC(=C(C=C3)O)O
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-[(2S,3S)-3-(hydroxymethyl)-6-[(E)-3-hydroxyprop-1-enyl]-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,2-diol
|
9818883 |
Click to see
C1=CC2=C(C=C1C=CCO)OC(C(O2)C3=CC(=C(C=C3)O)O)CO
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-[(3R)-2-(hydroxymethyl)-6-[(E)-3-hydroxyprop-1-enyl]-2,3-dihydro-1,4-benzodioxin-3-yl]benzene-1,2-diol
|
5318502 |
Click to see
C1=CC2=C(C=C1C=CCO)OC(C(O2)CO)C3=CC(=C(C=C3)O)O
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-[2-(Hydroxymethyl)-6-(3-hydroxyprop-1-enyl)-2,3-dihydro-1,4-benzodioxin-3-yl]benzene-1,2-diol
|
78385124 |
Click to see
C1=CC2=C(C=C1C=CCO)OC(C(O2)CO)C3=CC(=C(C=C3)O)O
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
4-[3-(Hydroxymethyl)-6-(3-hydroxyprop-1-enyl)-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,2-diol
|
73880695 |
Click to see
C1=CC2=C(C=C1C=CCO)OC(C(O2)C3=CC(=C(C=C3)O)O)CO
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
Americanol A
|
637304 |
Click to see
C1=CC2=C(C=C1C=CCO)OC(C(O2)C3=CC(=C(C=C3)O)O)CO
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
Isoamericanol A
|
6444016 |
Click to see
C1=CC2=C(C=C1C=CCO)OC(C(O2)CO)C3=CC(=C(C=C3)O)O
|
330.30 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
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(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(2S,3R)-3-(hydroxymethyl)-5-[(E)-3-hydroxyprop-1-enyl]-4-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2,6-dimethoxyphenoxy]oxane-3,4,5-triol
|
162932150 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C3C(C4=C(O3)C=CC(=C4OC)C=CCO)CO
|
550.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-(Hydroxymethyl)-6-[4-[3-(hydroxymethyl)-5-(3-hydroxyprop-1-enyl)-4-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2,6-dimethoxyphenoxy]oxane-3,4,5-triol
|
162932149 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C3C(C4=C(O3)C=CC(=C4OC)C=CCO)CO
|
550.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
2-(Hydroxymethyl)-6-[4-[3-(hydroxymethyl)-5-(3-hydroxyprop-1-enyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]oxane-3,4,5-triol
|
74184161 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)C=CCO
|
520.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
Alangilignoside B
|
101705429 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C(=C3)OC)OC4C(C(C(C(O4)CO)O)O)O)OC)C=CCO
|
550.60 |
unknown |
https://doi.org/10.1021/NP9006298 |
Dehydrodiconiferyl alcohol
|
5372367 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)C=CCO
|
358.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
Dehydrodiconiferyl alcohol 4-O-beta-D-glucopyranoside
|
5316442 |
Click to see
COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)OC)C=CCO
|
520.50 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
2-(3-Hydroxy-4-methoxyphenyl)-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one
|
12443209 |
Click to see
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
478.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
102317161 |
Click to see
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
478.40 |
unknown |
https://doi.org/10.1021/NP9006298 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
|
Apigetrin
|
5280704 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
432.40 |
unknown |
https://doi.org/10.1021/NP9006298 |