Hyodeoxycholic acid 500mg

CAT: 0628-A10460-500Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0628-A10460-500Size:500 mg

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CAS Number

83-49-8

Chemical Information

Hyodeoxycholic Acid

Hyodeoxycholic acid is a member of the class of 5beta-cholanic acids that is (5beta)-cholan-24-oic acid substituted by alpha-hydroxy groups at positions 3 and 6. It is a bioactive compound extracted from Calculus bovis. It has a role as a mouse metabolite and a human metabolite. It is a C24-steroid, a bile acid, a member of 5beta-cholanic acids and a 6alpha,20xi-murideoxycholic acid. It is functionally related to a cholic acid. It is a conjugate acid of a hyodeoxycholate.

CAS Number	83-49-8
PubChem CID	5283820
IUPAC Name	(4R)-4-[(3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-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
Molecular Formula	C24H40O4
Molecular Weight	392.6
XLogP	4.9
Topological Polar Surface Area	77.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	28
Formal Charge	0
Complexity	605

SMILES

C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C

InChI

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

InChIKey

DGABKXLVXPYZII-SIBKNCMHSA-N

Chemical Structure

2D Structure

CAS: 83-49-8

CID: 5283820

Formula: C24H40O4

MW: 392.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	392.6
XLogP3	4.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	392.29265975
Monoisotopic Mass	392.29265975
Topological Polar Surface Area	77.8 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	605
Isotope Atom Count	0
Defined Atom Stereocenter Count	10
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
014685	β-Hyodeoxycholic Acid
014684	α-Hyodeoxycholic Acid
OR1029111-01	Hyodeoxycholic Acid
HY-N0169R-01	Hyodeoxycholic acid (Standard)
014683	β-Hyodeoxycholic Acid-d4
TRC-H998105-50MG	beta-Hyodeoxycholic Acid
TRC-H998100-5G	alpha-Hyodeoxycholic Acid
S2311-100mg	Hyodeoxycholic acid (HDCA)
HY-D1732-01	FITC-hyodeoxycholic acid

Hyodeoxycholic acid 500mg

Chemical Information

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