Hydroxy-5-cholenic acid, 3β-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H38O3
Molecular Weight	374.5567
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Hydroxy-5-cholenic acid, 3β-

Structure Search

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(O)=O

InChI

InChIKey=HIAJCGFYHIANNA-QIZZZRFXSA-N

InChI=1S/C24H38O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h5,15,17-21,25H,4,6-14H2,1-3H3,(H,26,27)/t15-,17+,18+,19-,20+,21+,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H38O3
Molecular Weight	374.5567
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:46:13 GMT 2023` Edited by `admin` on `Sat Dec 16 15:46:13 GMT 2023`
Record UNII	EVD67Y26MR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Hydroxy-5-cholenic acid, 3β-

Common Name

English

3β-Hydroxy-5-cholenic acid

Common Name

English

3β-Hydroxycholenoic acid

Common Name

English

Δ5-Cholenic acid

Common Name

English

ZINC-04831336

Common Name

English

3β-Hydroxy-Δ5-cholenic acid

Systematic Name

English

(4R)-4-[(1R,3aS,3bS,7S,9aR,9bS,11aR)-7-hydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]pentanoic acid

Systematic Name

English

3β-Hydroxychol-5-en-24-ic acid

Common Name

English

Δ5-3β-Hydroxycholenic acid

Common Name

English

Chol-5-en-24-oic acid, 3-hydroxy-, (3β)-

Common Name

English

Cholenic acid

Common Name

English

(3β)-3-Hydroxychol-5-en-24-oic acid

Common Name

English

Code System Code Type Description

FDA UNII

EVD67Y26MR

Created by admin on Sat Dec 16 15:46:13 GMT 2023 , Edited by admin on Sat Dec 16 15:46:13 GMT 2023

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CAS

5255-17-4

Created by admin on Sat Dec 16 15:46:13 GMT 2023 , Edited by admin on Sat Dec 16 15:46:13 GMT 2023

PRIMARY

EPA CompTox

DTXSID901317558

Created by admin on Sat Dec 16 15:46:13 GMT 2023 , Edited by admin on Sat Dec 16 15:46:13 GMT 2023

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PUBCHEM

92997

Created by admin on Sat Dec 16 15:46:13 GMT 2023 , Edited by admin on Sat Dec 16 15:46:13 GMT 2023

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Related Record Type Details


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Sodium 3β-hydroxy-Δ5-cholenoate

SALT/SOLVATE -> PARENT

Amount: