Identità

7beta-Hydroxy-5beta-cholan-24-oic Acid

Mhux elenkat · C24H40O3

01Identità

Lazychem ID	LC-49084
CAS RN	Mhux elenkat
PubChem CID	5283808
Molecular formula	C24H40O3
Molecular weight	376.6 g/mol
IUPAC name	(4R)-4-[(5S,7S,8R,9S,10S,13R,14S,17R)-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
InChIKey	JVMCMMXFADJQKU-KEUPPCRPSA-N

02Struttura u stereokimika

Two-dimensional chemical structure of 7beta-Hydroxy-5beta-cholan-24-oic Acid — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aliphatic carbon, has 9 defined stereocentres. These statements are calculated from the published structure string.

Defined stereocentres	9
Ring count	4
Secondary amines	0
Tertiary amines	0

SMILES	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CCCC4)C)O)C
InChI	Mhux elenkat

03Stereochemistry

The published structure contains 9 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres9Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 512Before symmetry reduction

Published same-connectivity configurations

2 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.