HYOCHOLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H40O5
Molecular Weight	408.5714
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=DKPMWHFRUGMUKF-KWXDGCAGSA-N

InChI=1S/C24H40O5/c1-13(4-7-19(26)27)15-5-6-16-20-17(9-11-23(15,16)2)24(3)10-8-14(25)12-18(24)21(28)22(20)29/h13-18,20-22,25,28-29H,4-12H2,1-3H3,(H,26,27)/t13-,14-,15-,16+,17+,18+,20+,21-,22+,23-,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H40O5
Molecular Weight	408.5714
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Profile of urinary bile acids in infants and children: developmental pattern of excretion of unsaturated ketonic bile acids and 7beta-hydroxylated bile acids.	1999 Apr	10203155
Chemical diagnosis of Lesch-Nyhan syndrome using gas chromatography-mass spectrometry detection.	2003 Jul 15	12829005

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:51:36 GMT 2023` Edited by `admin` on `Fri Dec 15 19:51:36 GMT 2023`
Record UNII	2H5H0Q47FL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HYOCHOLIC ACID

Common Name

English

.GAMMA.-MURICHOLIC ACID

Common Name

English

CHOLAN-24-OIC ACID, 3,6,7-TRIHYDROXY-, (3.ALPHA.,5.BETA.,6.ALPHA.,7.ALPHA.)-

Common Name

English

.ALPHA.-HYOCHOLIC ACID

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID20862167