CHOLEST-5-EN-3-ONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H44O
Molecular Weight	384.6377
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

InChI

InChIKey=GGCLNOIGPMGLDB-GYKMGIIDSA-N

InChI=1S/C27H44O/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/h9,18-19,22-25H,6-8,10-17H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C27H44O
Molecular Weight	384.6377
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
GO:0016995 cholesterol oxidase activity 1 Target ID: GO:0016995 cholesterol oxidase activity Sources: https://www.ncbi.nlm.nih.gov/pubmed/19843167 \| https://www.ncbi.nlm.nih.gov/pubmed/10447682 \| https://www.ncbi.nlm.nih.gov/pubmed/8431456	Substrate 661

PubMed

Title	Date	PubMed
Cholesterol oxidase: biotechnological applications.	2009-12	19843167
Kinetic mechanisms of cholesterol oxidase from Streptomyces hygroscopicus and Brevibacterium sterolicum.	1999-08	10447682
Oxidation/isomerization of 5-cholesten-3 beta-ol and 5-cholesten-3-one to 4-cholesten-3-one in pure sterol and mixed phospholipid-containing monolayers by cholesterol oxidase.	1993-02-09	8431456

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:35:00 GMT 2025` Edited by `admin` on `Tue Apr 01 19:35:00 GMT 2025`
Record UNII	58D45D7T5H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-118979

Preferred Name

English

CHOLEST-5-EN-3-ONE

Systematic Name

English

3-KETOCHOLESTEROL

Common Name

English

3-OXOCHOLEST-5-ENE

Systematic Name

English

.DELTA.5-CHOLESTEN-3-ONE

Common Name

English

5-CHOLESTENONE

Systematic Name

English

5-CHOLESTEN-3-ONE

Systematic Name

English

.DELTA.5-CHOLESTERONE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID40208841

Created by admin on Tue Apr 01 19:35:01 GMT 2025 , Edited by admin on Tue Apr 01 19:35:01 GMT 2025

PRIMARY

NSC

118979