CHOLESTERYL BUTYRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H52O2
Molecular Weight	456.7434
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C

InChI

InChIKey=CKDZWMVGDHGMFR-GTPODGLVSA-N

InChI=1S/C31H52O2/c1-7-9-29(32)33-24-16-18-30(5)23(20-24)12-13-25-27-15-14-26(22(4)11-8-10-21(2)3)31(27,6)19-17-28(25)30/h12,21-22,24-28H,7-11,13-20H2,1-6H3/t22-,24+,25+,26-,27+,28+,30+,31-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C31H52O2
Molecular Weight	456.7434
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
cell growth 21 Target ID: GO:0016049 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11522486	Inhibitor 8504		0.075 mM [IC50]

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:07:51 GMT 2025` Edited by `admin` on `Mon Mar 31 19:07:51 GMT 2025`
Record UNII	50QA4YCP7F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHOLESTERYL BUTYRATE

Official Name

English

BUTYRIC ACID, CHOLESTERYL ESTER

Preferred Name

English

CHOLESTEROL N-BUTYRATE

Common Name

English

CHOLEST-5-EN-3-OL (3.BETA.)-, BUTANOATE

Common Name

English

3.BETA.-HYDROXY-5-CHOLESTENE 3-BUTYRATE

Systematic Name

English

CHOLESTEROL 3-BUTYRATE

Systematic Name

English

CHOLESTERYL N-BUTYRATE

Common Name

English

CHOLESTERYL BUTANOATE

Common Name

English

Code System Code Type Description

CAS

521-13-1