(Q105015377)

English

(2S)-2-[(1S)-1-[(8R,9S,10R,13S,14R,17S)-14,17-dihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

6-(1-{1,3a-dihydroxy-9a,11a-dimethyl-9-oxo-2H,3H,3bH,4H,6H,9bH,10H,11H-cyclopenta[a]phenanthren-1-yl}-1-hydroxyethyl)-3,4-dimethyl-5,6-dihydropyran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

470.266838936 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-2-[(1S)-1-[(8R,9S,10R,13S,14R,17S)-14,17-dihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

2 references

based on heuristic

inferred from InChIKey

1 reference

C₂₈H₃₈O₆

0 references

canonical SMILES

O=C1OC(CC(=C1C)C)C(O)(C)C2(O)CCC3(O)C4CC=C5CC=CC(=O)C5(C)C4CCC32C

0 references

isomeric SMILES

CC1=C(C)C(=O)O[C@H]([C@](C)(O)[C@]2(O)CC[C@@]3(O)[C@@H]4CC=C5CC=CC(=O)[C@]5(C)[C@H]4CC[C@]23C)C1

0 references

found in taxon

Withania adpressa

1 reference

stated in

Withanolides fromWithania adpressa

Identifiers

InChI

InChI=1S/C28H38O6/c1-16-15-22(34-23(30)17(16)2)26(5,31)28(33)14-13-27(32)20-10-9-18-7-6-8-21(29)25(18,4)19(20)11-12-24(27,28)3/h6,8-9,19-20,22,31-33H,7,10-15H2,1-5H3/t19-,20+,22-,24-,25-,26-,27+,28-/m0/s1

0 references

InChIKey

GQHHHBATDOXAEP-MXKUFHJFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GQHHHBATDOXAEP-MXKUFHJFSA-N

1 reference

(Q105015377)

(2S)-2-[(1S)-1-[(8R,9S,10R,13S,14R,17S)-14,17-dihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-1-hydroxyethyl]-4,5-dimethyl-2,3-dihydropyran-6-one

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)