GLYCOCHENODEOXYCHOLIC ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H43NO5
Molecular Weight	449.6233
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
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[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(=O)NCC(O)=O

InChI

InChIKey=GHCZAUBVMUEKKP-GYPHWSFCSA-N

InChI=1S/C26H43NO5/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16+,17-,18-,19+,20+,21-,24+,25+,26-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H43NO5
Molecular Weight	449.6233
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	9 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:03:04 UTC 2023` Edited by `admin` on `Sat Dec 16 01:03:04 UTC 2023`
Record UNII	451ZNJ667Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GLYCOCHENODEOXYCHOLIC ACID

Common Name

English

12-DEOXYCHOLYLGLYCINE

Common Name

English

CHENODEOXYGLYCOCHOLIC ACID

Common Name

English

12-DESOXYCHOLYLGLYCINE

Common Name

English

GLYCYLCHENODEOXYCHOLIC ACID

Common Name

English

GLYCINE, N-(3.ALPHA.,7.ALPHA.-DIHYDROXY-5.BETA.-CHOLAN-24-OYL)-

Systematic Name

English

GLYCINE, N-((3.ALPHA.,5.BETA.,7.ALPHA.)-3,7-DIHYDROXY-24-OXOCHOLAN-24-YL)-

Systematic Name

English

CHENODEOXYCHOLYLGLYCINE

Common Name

English

GLYCINE CHENODEOXYCHOLATE

Common Name

English

Classification Tree Code System Code

LOINC

2066-9