(Q104917625)

English

(3S,5R,6R,9R,10R,13R,14S,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

(3aR,5aR,9aR,9bR,11aR)-1-(5,6-dimethylhept-3-en-2-yl)-9a,11a-dimethyl-1H,2H,3H,3aH,5H,6H,7H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthrene-5,5a,7-triol

1 reference

based on heuristic

inferred from SMILES

(3S,5R,6R,9S,10R,13R,14R,17R)-17-[(E,2R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol

1 reference

based on heuristic

inferred from SMILES

17-(5,6-Dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol

1 reference

based on heuristic

inferred from SMILES

mass

430.344695332 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(22E)-Ergosta-7,22-diene-3beta,5beta,6alpha-triol

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,5R,6S,9R,10S,13R,14S,17R)-17-[(E,2S,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

3beta,5alpha,6beta-Trihydroxy-7,22-ergostadiene

1 reference

based on heuristic

inferred from InChI

22E,24R‐3β, 5α ,6α‐trihydroxyergosta-7, 22-diene

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₄₆O₃

0 references

canonical SMILES

OC1C=C2C3CCC(C(C=CC(C)C(C)C)C)C3(C)CCC2C4(C)CCC(O)CC14O

0 references

isomeric SMILES

CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]2C3=C[C@@H](O)[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@@]21C

0 references

found in taxon

Russula sardonia

1 reference

stated in

Sesquiterpenes from Russula sardonia

Identifiers

InChI

InChI=1S/C28H46O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,22+,23+,24+,25+,26+,27+,28-/m0/s1

0 references

InChIKey

ARXHRTZAVQOQEU-RPWACPSXSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104917625)

(3S,5R,6R,9R,10R,13R,14S,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-1,2,3,4,6,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-3,5,6-triol

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)