> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,15R,16R,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-15,16-diol
|
46865976 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)O)O)C)C)C)OC1
|
432.60 |
unknown |
via CMAUP database |
(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,15R,16R,18S)-15,16-dihydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one
|
10253011 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(C(=O)CC5C4CCC6C5(CC(C(C6)O)O)C)C)C)OC1
|
446.60 |
unknown |
via CMAUP database |
Chlorogenin
|
12303065 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC(C6C5(CCC(C6)O)C)O)C)C)OC1
|
432.60 |
unknown |
via CMAUP database |
Gitogenin
|
441887 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)O)O)C)C)C)OC1
|
432.60 |
unknown |
via CMAUP database |
Hecogenin
|
91453 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)O)C)C)C)OC1
|
430.60 |
unknown |
via CMAUP database |
Rockogenin
|
167555 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(C(CC5C4CCC6C5(CCC(C6)O)C)O)C)C)OC1
|
432.60 |
unknown |
via CMAUP database |
Sarsasapogenin
|
92095 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1
|
416.60 |
unknown |
via CMAUP database |
Smilagenin
|
91439 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1
|
416.60 |
unknown |
via CMAUP database |
Tigogenin
|
99516 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1
|
416.60 |
unknown |
via CMAUP database |
Yuccagenin
|
3083608 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CC(C(C6)O)O)C)C)C)OC1
|
430.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides
|
(2R)-2-[(3S,7R,8S,9S,10R,13S,14S,16S,17R)-7-hydroxy-10,13-dimethyl-3,16-bis[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylheptan-4-one
|
101620741 |
Click to see
CC(C)CC(=O)CC(C)C1C(CC2C1(CCC3C2C(C=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)O)C)OC6C(C(C(C(O6)CO)O)O)O
|
756.90 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins
|
(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18R)-16-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one
|
101243911 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)OC1
|
754.90 |
unknown |
via CMAUP database |
(1R,2S,4S,6R,7S,8R,9S,12S,13S,16S,18R)-16-[(2R,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3,4-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-7,9,13-trimethyl-5'-methylidenespiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one
|
101784689 |
Click to see
CC1C2C(CC3C2(C(=O)CC4C3CCC5C4(CCC(C5)OC6C(C(C(C(O6)CO)O)OC7C(C(C(C(O7)CO)O)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)OC19CCC(=C)CO9
|
915.00 |
unknown |
via CMAUP database |
(25R)-3beta-[4-O-[2-O-(3-O-beta-D-Xylopyranosyl-beta-D-glucopyranosyl)-3-O-beta-D-xylopyranosyl-beta-D-glucopyranosyl]-beta-D-galactopyranosyloxy]-5alpha-spirostane
|
21625854 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)CO)O)OC2C(C(C(CO2)O)O)O)O)O)O)C)C)C)OC1
|
1167.30 |
unknown |
via CMAUP database |
(2R,3R,4S,5S,6R)-2-[(2R)-4-[(1R,2S,4S,8S,9S,12S,13S,16S,18R)-16-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-6-en-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
101784691 |
Click to see
CC1=C(OC2C1C3(CCC4C(C3C2)CCC5C4(CCC(C5)OC6C(C(C(C(O6)CO)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)CCC(C)COC8C(C(C(C(O8)CO)O)O)O
|
903.10 |
unknown |
via CMAUP database |
(2S,3R,4R,5R,6S)-2-[(3R,4R,5R,6S)-6-[(2S,3R,4S,5R,6R)-2-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,15R,16R,18S)-15-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
|
71716476 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)OC2C(C(C(C(O2)C)O)O)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)O)C)C)C)OC1
|
1197.30 |
unknown |
via CMAUP database |
(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-3-hydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
21603422 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)OC8C(C(C(C(O8)CO)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)C)C)C)OC1
|
903.10 |
unknown |
via CMAUP database |
(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,15S,16R,18R)-15-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
10605143 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CC(C(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)O)C)C)C)OC1
|
756.90 |
unknown |
via CMAUP database |
(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(1R,2S,4S,5'R,6R,7S,8R,9S,10R,12S,13S,16S,18R)-10-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
101784690 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(C(CC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)O)C)C)OC1
|
756.90 |
unknown |
via CMAUP database |
(2S,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
21603426 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)OC1
|
740.90 |
unknown |
via CMAUP database |
Smilagenin 3-O-beta-D-glucopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-galactopyranoside
|
21603424 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)OC8C(C(C(C(O8)CO)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)C)C)C)OC1
|
903.10 |
unknown |
via CMAUP database |
Smilagenin 3-O-beta-D-glucopyranosyl-(1->2)-beta-D-galactopyranoside
|
10628815 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)OC1
|
740.90 |
unknown |
via CMAUP database |
Timosaponin A-III
|
15953793 |
Click to see
CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)OC1
|
740.90 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
Beta-Sitosterol
|
222284 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives
|
(2R,4S,4aR,6aR,6aR,6bR,8aS,12aS,14aR,14bR)-4-hydroxy-2,4a,6a,6a,8a,14a-hexamethyl-9-methylidene-2,4,5,6,6b,7,8,12,12a,13,14,14b-dodecahydro-1H-picen-3-one
|
162966198 |
Click to see
CC1CC2C(CCC3(C2(CCC4(C3CCC5(C4CC=CC5=C)C)C)C)C)(C(C1=O)O)C
|
424.70 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
|
(3E,4R,5S)-3-hexadec-15-enylidene-4-hydroxy-5-methyloxolan-2-one
|
162941517 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC=C)C(=O)O1)O
|
336.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3E,4R,5S)-3-hexadec-15-ynylidene-4-hydroxy-5-methyloxolan-2-one
|
162937202 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3E,4R,5S)-3-hexadecylidene-4-hydroxy-5-methyloxolan-2-one
|
10980677 |
Click to see
CCCCCCCCCCCCCCCC=C1C(C(OC1=O)C)O
|
338.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3E,4S,5S)-3-hexadec-15-enylidene-4-hydroxy-5-methyloxolan-2-one
|
162941518 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC=C)C(=O)O1)O
|
336.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3E,4S,5S)-3-hexadec-15-ynylidene-4-hydroxy-5-methyloxolan-2-one
|
162937203 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3E,4S,5S)-3-hexadecylidene-4-hydroxy-5-methyloxolan-2-one
|
11089057 |
Click to see
CCCCCCCCCCCCCCCC=C1C(C(OC1=O)C)O
|
338.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3Z,4R,5S)-3-hexadec-15-enylidene-4-hydroxy-5-methyloxolan-2-one
|
101697062 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC=C)C(=O)O1)O
|
336.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3Z,4R,5S)-3-hexadec-15-ynylidene-4-hydroxy-5-methyloxolan-2-one
|
101643340 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3Z,4S,5S)-3-hexadec-15-ynylidene-4-hydroxy-5-methyloxolan-2-one
|
101643341 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
3-Hexadec-15-enylidene-4-hydroxy-5-methyloxolan-2-one
|
550667 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC=C)C(=O)O1)O
|
336.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
3-Hexadec-15-ynylidene-4-hydroxy-5-methyloxolan-2-one
|
550661 |
Click to see
CC1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
3-Hexadecylidene-4-hydroxy-5-methyloxolan-2-one
|
85318000 |
Click to see
CCCCCCCCCCCCCCCC=C1C(C(OC1=O)C)O
|
338.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
> Organoheterocyclic compounds / Oxolanes
|
(3E,4R)-3-(15-Hexadecyn-1-ylidene)dihydro-4beta-hydroxy-5-methylene-2(3H)-furanone
|
101643338 |
Click to see
C=C1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3R,2E)-2-(Hexadec-15-ynylidene)-3-hydroxy-4-methylenebutanolide
|
91691263 |
Click to see
C=C1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
4-Hydroxy-5-methylidene-3-octadecylideneoxolan-2-one
|
370916 |
Click to see
CCCCCCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
364.60 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
Isomahubannolide-23
|
46237230 |
Click to see
CCCCCCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
364.60 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
> Organoheterocyclic compounds / Tetrahydrofurans
|
(3E,4R)-3-hexadec-15-enylidene-4-hydroxy-5-methylideneoxolan-2-one
|
162853106 |
Click to see
C=CCCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3E)-3-hexadec-15-ynylidene-4-hydroxy-5-methylideneoxolan-2-one
|
5362847 |
Click to see
C=C1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
(3Z,4R)-3-hexadec-15-enylidene-4-hydroxy-5-methylideneoxolan-2-one
|
15929285 |
Click to see
C=CCCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
3-Hexadec-15-enylidene-4-hydroxy-5-methylideneoxolan-2-one
|
162853105 |
Click to see
C=CCCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
3-Hexadec-15-ynylidene-4-hydroxy-5-methylideneoxolan-2-one
|
535021 |
Click to see
C=C1C(C(=CCCCCCCCCCCCCCC#C)C(=O)O1)O
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)84166-7 |
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
|
(2'R,3R)-4',6,6'-trihydroxy-2'-(4-hydroxyphenyl)-7-methoxy-4-[(E)-2-[(2'R,3R)-4',6,6'-trihydroxy-2'-(4-hydroxyphenyl)-2-oxospiro[1-benzofuran-3,3'-2H-1-benzofuran]-4-yl]ethenyl]spiro[1-benzofuran-3,3'-2H-1-benzofuran]-2-one
|
17757603 |
Click to see
COC1=C(C=C(C2=C1OC(=O)C23C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)C=CC6=C7C(=CC(=C6)O)OC(=O)C78C(OC9=CC(=CC(=C89)O)O)C1=CC=C(C=C1)O)O
|
810.70 |
unknown |
via CMAUP database |
(2'R,3S)-4',6,6'-trihydroxy-2'-(4-hydroxyphenyl)-7-methoxy-4-[(E)-2-[(2'R,3S)-4',6,6'-trihydroxy-2'-(4-hydroxyphenyl)-2-oxospiro[1-benzofuran-3,3'-2H-1-benzofuran]-4-yl]ethenyl]spiro[1-benzofuran-3,3'-2H-1-benzofuran]-2-one
|
17755939 |
Click to see
COC1=C(C=C(C2=C1OC(=O)C23C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)C=CC6=C7C(=CC(=C6)O)OC(=O)C78C(OC9=CC(=CC(=C89)O)O)C1=CC=C(C=C1)O)O
|
810.70 |
unknown |
via CMAUP database |
Gloriosaol D
|
102380006 |
Click to see
COC1=C(C=C(C2=C1OC(=O)C23C(OC4=CC(=CC(=C34)O)O)C5=CC=C(C=C5)O)C=CC6=C7C(=CC(=C6)O)OC(=O)C78C(OC9=CC(=CC(=C89)O)O)C1=CC=C(C=C1)O)O
|
810.70 |
unknown |
via CMAUP database |