(Q106040894)

English

Isofucostanol

chemical compound

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

In more languages

Statements

type of chemical entity

0 references

stigmastan-type steroid

1 reference

based on heuristic

inferred from SMILES

414.38616622 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,3aS,3bR,5aS,7S,9aS,9bS,11aR)-1-[(2R,5Z)-5-isopropylhept-5-en-2-yl]-9a,11a-dimethyl-tetradecahydro-1H-cyclopenta[a]phenanthren-7-ol

1 reference

based on heuristic

inferred from InChI

(3R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-5-propan-2-ylhept-5-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

based on heuristic

inferred from InChI

(24E)-24-Ethylidene-5alpha-cholestan-3beta-ol

1 reference

based on heuristic

inferred from InChI

5alpha-24E-ethylidene-cholestan-3beta-ol

1 reference

based on heuristic

inferred from InChI

(3R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(E,2R)-5-propan-2-ylhept-5-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

based on heuristic

inferred from InChI

chemical formula

C₂₉H₅₀O

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC=C(CCC(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C)C(C)C

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C/C=C(/CCC(C)[C@H]1CC[C@H]2[C@@H]3CCC4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,19-20,22-27,30H,8-18H2,1-6H3/b21-7-/t20?,22?,23?,24-,25+,26-,27-,28-,29+/m0/s1

1 reference

ChEBI release 2021-03-01

CQSRUKJFZKVYCY-WZJYZIMXSA-N

1 reference

ChEBI release 2021-03-01

2 references

ChEBI release 2021-03-01

matched by identifier from

CQSRUKJFZKVYCY-WZJYZIMXSA-N

mapping relation type

2 references

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,19-20,22-27,30H,8-18H2,1-6H3/b21-7-/t20?,22?,23?,24-,25+,26-,27-,28-,29+/m0/s1

UniChem compound ID

1 reference

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