7-Keto Valbenazine

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H36N2O5
Molecular Weight	432.553
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12C[C@@H](OC(=O)[C@@H](N)C(C)C)[C@H](CC(C)C)CN1CC(=O)C3=CC(OC)=C(OC)C=C23

InChI

InChIKey=LLDNCNDMEFJGAL-JOJCTQJUSA-N

InChI=1S/C24H36N2O5/c1-13(2)7-15-11-26-12-19(27)17-9-22(30-6)21(29-5)8-16(17)18(26)10-20(15)31-24(28)23(25)14(3)4/h8-9,13-15,18,20,23H,7,10-12,25H2,1-6H3/t15-,18-,20-,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H36N2O5
Molecular Weight	432.553
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:17:59 GMT 2023` Edited by `admin` on `Sat Dec 16 18:17:59 GMT 2023`
Record UNII	AWS7WJ5RGW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7-Keto Valbenazine

Common Name

English

L-Valine, (2R,3R,11bR)-1,3,4,6,7,11b-hexahydro-9,10-dimethoxy-3-(2-methylpropyl)-7-oxo-2H-benzo[a]quinolizin-2-yl ester

Systematic Name

English

Code System Code Type Description

FDA UNII

AWS7WJ5RGW

Created by admin on Sat Dec 16 18:17:59 GMT 2023 , Edited by admin on Sat Dec 16 18:17:59 GMT 2023

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CAS

2624055-87-2

Created by admin on Sat Dec 16 18:17:59 GMT 2023 , Edited by admin on Sat Dec 16 18:17:59 GMT 2023

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PUBCHEM

129278973

Created by admin on Sat Dec 16 18:17:59 GMT 2023 , Edited by admin on Sat Dec 16 18:17:59 GMT 2023

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