3-AMINO-12-HYDROXY-CHOLAN-24-OIC ACID, (3.BETA.,5.BETA.,12.ALPHA.)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H41NO3
Molecular Weight	391.5872
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-AMINO-12-HYDROXY-CHOLAN-24-OIC ACID, (3.BETA.,5.BETA.,12.ALPHA.)-

Structure Search

SMILES

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

InChI

InChIKey=FAASTKYIPSDJDD-OFYXWCICSA-N

InChI=1S/C24H41NO3/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,26H,4-13,25H2,1-3H3,(H,27,28)/t14-,15-,16+,17+,18-,19+,20+,21+,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H41NO3
Molecular Weight	391.5872
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 `Sat Dec 16 07:15:39 GMT 2023` Edited by `admin` on `Sat Dec 16 07:15:39 GMT 2023`
Record UNII	51MV9Y7YCB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-AMINO-12-HYDROXY-CHOLAN-24-OIC ACID, (3.BETA.,5.BETA.,12.ALPHA.)-

Common Name

English

CHOLAN-24-OIC ACID, 3-AMINO-12-HYDROXY-, (3.BETA.,5.BETA.,12.ALPHA.)-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID20196555

Created by admin on Sat Dec 16 07:15:39 GMT 2023 , Edited by admin on Sat Dec 16 07:15:39 GMT 2023

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FDA UNII

51MV9Y7YCB

Created by admin on Sat Dec 16 07:15:39 GMT 2023 , Edited by admin on Sat Dec 16 07:15:39 GMT 2023

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PUBCHEM

23391050

Created by admin on Sat Dec 16 07:15:39 GMT 2023 , Edited by admin on Sat Dec 16 07:15:39 GMT 2023

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CAS

455892-74-7

Created by admin on Sat Dec 16 07:15:39 GMT 2023 , Edited by admin on Sat Dec 16 07:15:39 GMT 2023

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