> Alkaloids and derivatives / Aporphines
|
(6aR)-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-1,11-diol
|
929259 |
Click to see
C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C
|
342.40 |
unknown |
via CMAUP database |
(R)-5,6,6a,7-Tetrahydro-1,2,9,10-tetramethoxy-6-methyl-4H-dibenzo(de,g)quinoline
|
1078819 |
Click to see
CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC)OC)OC
|
355.40 |
unknown |
via CMAUP database |
> Alkaloids and derivatives / Protoberberine alkaloids and derivatives
|
Berberine
|
2353 |
Click to see
COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC
|
336.40 |
unknown |
via CMAUP database |
Discretinine
|
11186895 |
Click to see
COC1=C(C2=C(CC3C4=CC(=C(C=C4CCN3C2)O)OC)C=C1)OC
|
341.40 |
unknown |
via CMAUP database |
Jatrorrhizine
|
72323 |
Click to see
COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)O)OC)OC
|
338.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds
|
(1S,14R)-20,21,25-trimethoxy-15,30-dimethyl-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.29,12.13,7.114,18.027,31.022,33]hexatriaconta-3(36),4,6,9(35),10,12(34),18,20,22(33),24,26,31-dodecaen-6-ol
|
5320345 |
Click to see
CN1CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=CC(=C(C=C7CCN6C)OC)O3)O)OC)OC
|
608.70 |
unknown |
via CMAUP database |
Berbamine
|
275182 |
Click to see
CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)O)OC
|
608.70 |
unknown |
via CMAUP database |
Oxyacanthine
|
442333 |
Click to see
CN1CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=CC(=C(C=C7CCN6C)OC)O3)O)OC)OC
|
608.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
|
(14-Ethoxy-2-hydroxy-5,9,14-trimethyl-5-tetracyclo[11.2.1.01,10.04,9]hexadec-11-enyl)methyl acetate
|
162978945 |
Click to see
CCOC1(CC23CC1C=CC2C4(CCCC(C4CC3O)(C)COC(=O)C)C)C
|
390.60 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(1R,2S,4S,9R,10S,13R)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol
|
163013899 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)O)C)C
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(1R,4R,5S,9R,10S,13R,15S)-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-15-ol
|
162959623 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4O)C)CO
|
304.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(1S,4R,9S,10R,13R)-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane
|
162964444 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C
|
272.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(2-Acetyloxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl)methyl acetate
|
13858156 |
Click to see
CC(=O)OCC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)OC(=O)C)C)C
|
388.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(2-Acetyloxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl)methyl hexadecanoate
|
14487061 |
Click to see
CCCCCCCCCCCCCCCC(=O)OCC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)OC(=O)C)C)C
|
584.90 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(2-Acetyloxy-5,9,13-trimethyl-5-pentacyclo[11.2.1.01,10.04,9.012,14]hexadecanyl)methyl acetate
|
14890427 |
Click to see
CC(=O)OCC1(CCCC2(C1CC(C34C2CC5C(C3)C5(C4)C)OC(=O)C)C)C
|
388.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(4S)-Kaur-16-ene-7beta,19-diol 7-acetate 19-palmitate
|
101526599 |
Click to see
CCCCCCCCCCCCCCCC(=O)OCC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)OC(=O)C)C)C
|
584.90 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
(5,5,9-Trimethyl-14-methylidene-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl) acetate
|
14890425 |
Click to see
CC(=O)OC1CC2C(CCCC2(C3C14CC(CC3)C(=C)C4)C)(C)C
|
330.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1R,2S,4R,5S,9R,10S,13S,14R)-14-ethoxy-2-hydroxy-5,9,14-trimethyl-5-tetracyclo[11.2.1.01,10.04,9]hexadec-11-enyl]methyl acetate
|
162978946 |
Click to see
CCOC1(CC23CC1C=CC2C4(CCCC(C4CC3O)(C)COC(=O)C)C)C
|
390.60 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1R,2S,4R,5S,9R,10S,13S,14R)-14-ethoxy-5-(hydroxymethyl)-5,9,14-trimethyl-2-tetracyclo[11.2.1.01,10.04,9]hexadec-11-enyl] acetate
|
162874135 |
Click to see
CCOC1(CC23CC1C=CC2C4(CCCC(C4CC3OC(=O)C)(C)CO)C)C
|
390.60 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1R,2S,4S,5S,9R,10S,12R,13R,14S)-2-acetyloxy-5,9,13-trimethyl-5-pentacyclo[11.2.1.01,10.04,9.012,14]hexadecanyl]methyl acetate
|
101599473 |
Click to see
CC(=O)OCC1(CCCC2(C1CC(C34C2CC5C(C3)C5(C4)C)OC(=O)C)C)C
|
388.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1R,2S,4S,5S,9R,10S,13R)-2-acetyloxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate
|
101615201 |
Click to see
CC(=O)OCC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)OC(=O)C)C)C
|
388.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1R,2S,4S,5S,9R,10S,13R)-2-hydroxy-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl hexadecanoate
|
101615202 |
Click to see
CCCCCCCCCCCCCCCC(=O)OCC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)O)C)C
|
542.90 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1R,2S,4S,9R,10S,13R)-5,5,9-trimethyl-14-methylidene-2-tetracyclo[11.2.1.01,10.04,9]hexadecanyl] acetate
|
163019438 |
Click to see
CC(=O)OC1CC2C(CCCC2(C3C14CC(CC3)C(=C)C4)C)(C)C
|
330.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1S,4R,5S,9S,10R,13R)-5,9-dimethyl-14-methylidene-5-tetracyclo[11.2.1.01,10.04,9]hexadecanyl]methyl acetate
|
163075712 |
Click to see
CC(=O)OCC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C
|
330.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[(1S,4S,5S,9S,10S,13R)-5-(hydroxymethyl)-5,9-dimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadec-14-enyl]methanol
|
101599474 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C4)CO)C)CO
|
304.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[14-Ethoxy-5-(hydroxymethyl)-5,9,14-trimethyl-2-tetracyclo[11.2.1.01,10.04,9]hexadec-11-enyl] acetate
|
162874134 |
Click to see
CCOC1(CC23CC1C=CC2C4(CCCC(C4CC3OC(=O)C)(C)CO)C)C
|
390.60 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[5-(Hydroxymethyl)-5,9-dimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadec-14-enyl]methanol
|
14890418 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C4)CO)C)CO
|
304.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
[5-(Hydroxymethyl)-5,9,13-trimethyl-2-pentacyclo[11.2.1.01,10.04,9.012,14]hexadecanyl] acetate
|
163059115 |
Click to see
CC(=O)OC1CC2C(CCCC2(C3C14CC5C(C3)C5(C4)C)C)(C)CO
|
346.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
2-[(1R,2S,4R,5S,9R,10S,13R)-2-hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadec-14-enyl]acetaldehyde
|
163043629 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C4)CC=O)O)C)CO
|
332.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
2-[2-Hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-tetracyclo[11.2.1.01,10.04,9]hexadec-14-enyl]acetaldehyde
|
14890429 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C4)CC=O)O)C)CO
|
332.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
5-(Hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol
|
13858160 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)O)C)CO
|
304.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
5,5,9-Trimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecan-2-ol
|
14890423 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)O)C)C
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
7-Acetoxy-18-trachylobanol
|
102239718 |
Click to see
CC(=O)OC1CC2C(CCCC2(C3C14CC5C(C3)C5(C4)C)C)(C)CO
|
346.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
7-Epi candicandiol
|
45267086 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)O)C)CO
|
304.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
7beta,19-Dihydroxykaur-15-ene-17-carbaldehyde
|
14890430 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C4)CC=O)O)C)CO
|
332.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Candicandiol
|
20055798 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)O)C)CO
|
304.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Candidiol
|
101316736 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4O)C)CO
|
304.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Candol A
|
14890424 |
Click to see
CC1(CCCC2(C1CC(C34C2CCC(C3)C(=C)C4)O)C)C
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Candol A acetate
|
14890426 |
Click to see
CC(=O)OC1CC2C(CCCC2(C3C14CC(CC3)C(=C)C4)C)(C)C
|
330.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Candol B
|
101289732 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)CO
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
ent-16-Kauren-19-ol
|
529650 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)CO
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
ent-Kaurene
|
11966109 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C
|
272.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Kaur-16-ene
|
520687 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)C
|
272.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Kaura-16-ene-7beta,19-diol 7-acetate
|
101615200 |
Click to see
CC(=O)OC1CC2C(CCCC2(C3C14CC(CC3)C(=C)C4)C)(C)CO
|
346.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(3R,6E)-nerolidol
|
11241545 |
Click to see
CC(=CCCC(=CCCC(C)(C=C)O)C)C
|
222.37 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
Nerolidol
|
8888 |
Click to see
CC(=CCCC(=CCCC(C)(C=C)O)C)C
|
222.37 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides
|
2-[[5,7-dihydroxy-7-(hydroxymethyl)-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-1-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
73804138 |
Click to see
C1C(C2C=COC(C2C1(CO)O)OC3C(C(C(C(O3)CO)O)O)O)O
|
364.34 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
Glutinol
|
9932254 |
Click to see
CC1(CCC2(CCC3(C4CC=C5C(C4(CCC3(C2C1)C)C)CCC(C5(C)C)O)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins
|
Anemarrhenasaponin I
|
9810764 |
Click to see
CC1C2C(C(C3C2(CCC4C3CCC5C4(CCC(C5)OC6C(C(C(C(O6)CO)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)O)OC1(CCC(C)C)O
|
758.90 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
86821 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
24-Ethylcholest-5-en-3beta-ol
|
22012 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Organic acids and derivatives / Peptidomimetics / Depsipeptides / Cyclic depsipeptides
|
cyclo[DL-Abu-DL-Val-DL-N(Me)Ala-bAla-DL-OLeu-DL-Pro]
|
75049028 |
Click to see
CCC1C(=O)NC(C(=O)N(C(C(=O)NCCC(=O)OC(C(=O)N2CCCC2C(=O)N1)CC(C)C)C)C)C(C)C
|
551.70 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Organoheterocyclic compounds / Naphthofurans
|
[(5R,5aS,9aS,9bS)-9b-hydroxy-6,6,9a-trimethyl-1-oxo-3,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl] (7R)-7-hydroxy-6-oxoocta-2,4-dienoate
|
162869100 |
Click to see
CC(C(=O)C=CC=CC(=O)OC1C=C2COC(=O)C2(C3(C1C(CCC3)(C)C)C)O)O
|
418.50 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
|
Eupatorin
|
97214 |
Click to see
COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O
|
344.30 |
unknown |
https://doi.org/10.1016/0031-9422(91)85278-8 |