(Q104947223)

English

(3R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(E,2R)-6-methylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

10,13-dimethyl-17-(6-methylhept-3-en-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

1 reference

386.354866092 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

5alpha-cholest-22E-en-3beta-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

5beta-cholest-22E-en-3beta-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₄₆O

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canonical SMILES

OC1CCC2(C)C(CCC3C4CCC(C(C=CCC(C)C)C)C4(C)CCC32)C1

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isomeric SMILES

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

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found in taxon

Amphilectus fucorum

1 reference

stated in

Novel sterols from the sponge esperiopsis edwardii

Identifiers

InChI

InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h6,8,18-25,28H,7,9-17H2,1-5H3/b8-6+/t19-,20+,21-,22+,23-,24+,25+,26+,27-/m1/s1

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InChIKey

BWGQUGBECNWWDB-NLPHHWCYSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q104947223)

(3R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(E,2R)-6-methylhept-3-en-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol

Statements

Identifiers

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