> Benzenoids / Phenols / Methoxyphenols
|
Guaiacol
|
460 |
Click to see
COC1=CC=CC=C1O
|
124.14 |
unknown |
https://doi.org/10.1021/NP0102051 |
> Lignans, neolignans and related compounds / Lignan glycosides
|
(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-[(2R,3S,4S,5R)-5-(4-hydroxy-3-methoxyphenyl)-3,4-bis(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol
|
11767553 |
Click to see
COC1=C(C=CC(=C1)C2C(C(C(O2)C3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)OC5C(C(CO5)(CO)O)O)OC)CO)CO)O
|
670.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
5-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-[5-(4-hydroxy-3-methoxyphenyl)-3,4-bis(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol
|
73093649 |
Click to see
COC1=C(C=CC(=C1)C2C(C(C(O2)C3=CC(=C(C=C3)OC4C(C(C(C(O4)CO)O)O)OC5C(C(CO5)(CO)O)O)OC)CO)CO)O
|
670.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
|
(1S,3R,6S,8R,9S,11S,12S,14S,15R,16R)-15-[(2R,5S)-5-hydroxy-2,6,6-trimethyloxan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,9,14-triol
|
21592457 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(C(O6)(C)C)O)C)O)C)C)O)O)C
|
490.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
(1S,3R,6S,8R,9S,11S,12S,15S,16R)-6,9-dihydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-14-one
|
21592458 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(=O)C5C6(CCC(O6)C(C)(C)O)C)C)C)O)O)C
|
488.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
(1S,3R,8R,11S,12S,16R)-15-[(2R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,9,14-triol
|
137704501 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C)(C)O)C)O)C)C)O)O)C
|
490.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
15-(5-Hydroxy-2,6,6-trimethyloxan-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,9,14-triol
|
73809390 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(C(O6)(C)C)O)C)O)C)C)O)O)C
|
490.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
6,9-Dihydroxy-15-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-14-one
|
73809391 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(=O)C5C6(CCC(O6)C(C)(C)O)C)C)C)O)O)C
|
488.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
Astramembrangenin
|
13943288 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C)(C)O)C)O)C)C)O)O)C
|
490.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
Cyclogalegigenin
|
3664530 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C)(C)O)C)O)C)C)O)O)C
|
490.70 |
unknown |
https://doi.org/10.1021/NP0102051 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
3-Hydroxylup-20(29)-en-28-amide
|
10161414 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)N
|
455.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins / Cucurbitacin glycosides
|
(2R,3R,4S,5S,6R)-2-[[(1S,3R,6S,8S,9S,11R,12S,14S,15S,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
163043936 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C)(C)O)C)O)C)C)OC7C(C(C(C(O7)CO)O)O)O)OC8C(C(C(C(O8)CO)O)O)O)C
|
815.00 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-4,5-dihydroxy-2-[[(1S,3R,6S,8S,9S,11R,12S,14S,15S,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
|
162905842 |
Click to see
CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC45CC46CCC7(C(C(CC7(C6CC(C5C3(C)C)OC8C(C(C(CO8)O)O)O)C)O)C9(CCC(O9)C(C)(C)O)C)C)O)O)O)O)O
|
901.10 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
(2S,3R,4S,5R)-2-[[(1S,3R,6S,8S,9S,11R,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxane-3,4,5-triol
|
162910903 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C)(C)O)C)O)C)C)OC7C(C(C(CO7)O)O)O)OC8C(C(C(CO8)O)O)O)C
|
754.90 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
[(2S,3R,4S,5R)-4,5-dihydroxy-2-[[(1S,3R,6S,8S,9S,11R,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-3-yl] acetate
|
162957939 |
Click to see
CC(=O)OC1C(C(COC1OC2CCC34CC35CCC6(C(C(CC6(C5CC(C4C2(C)C)OC7C(C(C(CO7)O)O)O)C)O)C8(CCC(O8)C(C)(C)O)C)C)O)O
|
797.00 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
[4,5-Dihydroxy-2-[[14-hydroxy-15-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-3-yl] acetate
|
4670607 |
Click to see
CC(=O)OC1C(C(COC1OC2CCC34CC35CCC6(C(C(CC6(C5CC(C4C2(C)C)OC7C(C(C(CO7)O)O)O)C)O)C8(CCC(O8)C(C)(C)O)C)C)O)O
|
797.00 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
1-(4,5-Dihydroxy-1,5-dimethylhexyl)-2,5-dihydroxy-3a,6,6,12a-tetramethyltetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthren-7-yl hexopyranoside
|
495619 |
Click to see
CC(CCC(C(C)(C)O)O)C1C(CC2(C1(CCC34C2CC(C5C3(C4)CCC(C5(C)C)OC6C(C(C(C(O6)CO)O)O)O)O)C)C)O
|
654.90 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
2-[[14-Hydroxy-15-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxane-3,4,5-triol
|
3665113 |
Click to see
CC1(C(CCC23C1C(CC4C2(C3)CCC5(C4(CC(C5C6(CCC(O6)C(C)(C)O)C)O)C)C)OC7C(C(C(CO7)O)O)O)OC8C(C(C(CO8)O)O)O)C
|
754.90 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
2-[4,5-Dihydroxy-2-[[14-hydroxy-15-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-(3,4,5-trihydroxyoxan-2-yl)oxy-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
|
5176453 |
Click to see
CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC45CC46CCC7(C(C(CC7(C6CC(C5C3(C)C)OC8C(C(C(CO8)O)O)O)C)O)C9(CCC(O9)C(C)(C)O)C)C)O)O)O)O)O
|
901.10 |
unknown |
https://doi.org/10.1016/S0031-9422(00)90598-3 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenoxy]oxane-3,4-diol
|
21629878 |
Click to see
COC1=C(C=CC(=C1)C=CCO)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O
|
474.50 |
unknown |
https://doi.org/10.1021/NP0102051 |
(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-(2,6-dihydroxy-4-methoxyphenoxy)-2-(hydroxymethyl)oxane-3,4-diol
|
11134140 |
Click to see
COC1=CC(=C(C(=C1)O)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O)O
|
450.40 |
unknown |
https://doi.org/10.1021/NP0102051 |
(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-(4-hydroxy-3-methoxyphenoxy)-2-(hydroxymethyl)oxane-3,4-diol
|
10917065 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O)O
|
434.40 |
unknown |
https://doi.org/10.1021/NP0102051 |
(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-[(1S)-1,3-dihydroxypropyl]-2-methoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol
|
163185757 |
Click to see
COC1=C(C=CC(=C1)C(CCO)O)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O
|
492.50 |
unknown |
https://doi.org/10.1021/NP0102051 |
5-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[4-(3-hydroxyprop-1-enyl)-2-methoxyphenoxy]oxane-3,4-diol
|
73814586 |
Click to see
COC1=C(C=CC(=C1)C=CCO)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O
|
474.50 |
unknown |
https://doi.org/10.1021/NP0102051 |
5-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-(2,6-dihydroxy-4-methoxyphenoxy)-2-(hydroxymethyl)oxane-3,4-diol
|
85410810 |
Click to see
COC1=CC(=C(C(=C1)O)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O)O
|
450.40 |
unknown |
https://doi.org/10.1021/NP0102051 |
5-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-(4-hydroxy-3-methoxyphenoxy)-2-(hydroxymethyl)oxane-3,4-diol
|
22297254 |
Click to see
COC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O)O
|
434.40 |
unknown |
https://doi.org/10.1021/NP0102051 |
5-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-6-[4-(1,3-dihydroxypropyl)-2-methoxyphenoxy]-2-(hydroxymethyl)oxane-3,4-diol
|
85395922 |
Click to see
COC1=C(C=CC(=C1)C(CCO)O)OC2C(C(C(C(O2)CO)O)O)OC3C(C(CO3)(CO)O)O
|
492.50 |
unknown |
https://doi.org/10.1021/NP0102051 |
> Phenylpropanoids and polyketides / Coumarins and derivatives
|
Coumarin
|
323 |
Click to see
C1=CC=C2C(=C1)C=CC(=O)O2
|
146.14 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Coumarin glycosides
|
7-hydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
|
22524175 |
Click to see
C1=CC(=C(C2=C1C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O)O
|
340.28 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 5-methoxypsoralens
|
Bergapten
|
2355 |
Click to see
COC1=C2C=CC(=O)OC2=CC3=C1C=CO3
|
216.19 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 8-methoxypsoralens
|
Methoxsalen
|
4114 |
Click to see
COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2
|
216.19 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7,8-dihydroxycoumarins
|
Daphnetin
|
5280569 |
Click to see
C1=CC(=C(C2=C1C=CC(=O)O2)O)O
|
178.14 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 7-hydroxycoumarins
|
Umbelliferone
|
5281426 |
Click to see
C1=CC(=CC2=C1C=CC(=O)O2)O
|
162.14 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflavanquinones
|
2-(7,8-dimethoxy-3,4-dihydro-2H-chromen-3-yl)-6-hydroxycyclohexa-2,5-diene-1,4-dione
|
3678565 |
Click to see
COC1=C(C2=C(CC(CO2)C3=CC(=O)C=C(C3=O)O)C=C1)OC
|
316.30 |
unknown |
https://doi.org/10.1016/S0031-9422(00)89728-9 |
> Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 4-O-methylated isoflavonoids
|
(3R)-3-(2,3,4-trimethoxyphenyl)-3,4-dihydro-2H-chromen-7-ol
|
15118760 |
Click to see
COC1=C(C(=C(C=C1)C2CC3=C(C=C(C=C3)O)OC2)OC)OC
|
316.30 |
unknown |
https://doi.org/10.1016/S0031-9422(00)89728-9 |
> Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 8-O-methylated isoflavonoids
|
(3S)-3-(2-hydroxy-4-methoxyphenyl)-8-methoxy-3,4-dihydro-2H-chromen-7-ol
|
10335070 |
Click to see
COC1=CC(=C(C=C1)C2CC3=C(C(=C(C=C3)O)OC)OC2)O
|
302.32 |
unknown |
https://doi.org/10.1016/S0031-9422(00)89728-9 |