3.BETA.,7.BETA.-DIHYDROXY-5.BETA.-CHOLAN-24-OIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H40O4
Molecular Weight	392.572
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3.BETA.,7.BETA.-DIHYDROXY-5.BETA.-CHOLAN-24-OIC ACID

Structure Search

SMILES

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

InChI

InChIKey=RUDATBOHQWOJDD-DNMBCGTGSA-N

InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16+,17-,18+,19+,20+,22+,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H40O4
Molecular Weight	392.572
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 00:45:03 GMT 2025` Edited by `admin` on `Wed Apr 02 00:45:03 GMT 2025`
Record UNII	2R6LC4J3N9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3.BETA.,7.BETA.-DIHYDROXY-5.BETA.-CHOLAN-24-OIC ACID

Systematic Name

English

3.BETA.-URSODEOXYCHOLIC ACID

Preferred Name

English

3.BETA.,7.BETA.-DIHYDROXY-5.BETA.-CHOLANOIC ACID

Systematic Name

English

URSODEOXYCHOLIC ACID IMPURITY H [EP IMPURITY]

Common Name

English

3.BETA.,7.BETA.-DIHYDROXY-5.BETA.-CHOLANIC ACID

Systematic Name

English

ISOURSODEOXYCHOLIC ACID

Common Name

English

CHOLAN-24-OIC ACID, 3,7-DIHYDROXY-, (3.BETA.,5.BETA.,7.BETA.)-

Systematic Name

English

Code System Code Type Description

CAS

78919-26-3