(2R,3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro2H-benzo[a]quinolizin-2-yl D-valinate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H38N2O4
Molecular Weight	418.5695
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2R,3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro2H-benzo[a]quinolizin-2-yl D-valinate

Structure Search

SMILES

[H][C@]12C[C@@H](OC(=O)[C@H](N)C(C)C)[C@H](CC(C)C)CN1CCC3=CC(OC)=C(OC)C=C23

InChI

InChIKey=GEJDGVNQKABXKG-ZDXOVATRSA-N

InChI=1S/C24H38N2O4/c1-14(2)9-17-13-26-8-7-16-10-21(28-5)22(29-6)11-18(16)19(26)12-20(17)30-24(27)23(25)15(3)4/h10-11,14-15,17,19-20,23H,7-9,12-13,25H2,1-6H3/t17-,19-,20-,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H38N2O4
Molecular Weight	418.5695
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 18:31:15 GMT 2023` Edited by `admin` on `Sat Dec 16 18:31:15 GMT 2023`
Record UNII	YVA56959WX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2R,3R,11bR)-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11b-hexahydro2H-benzo[a]quinolizin-2-yl D-valinate

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID901107642

Created by admin on Sat Dec 16 18:31:15 GMT 2023 , Edited by admin on Sat Dec 16 18:31:15 GMT 2023

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CAS

1025504-59-9

Created by admin on Sat Dec 16 18:31:15 GMT 2023 , Edited by admin on Sat Dec 16 18:31:15 GMT 2023

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FDA UNII

YVA56959WX

Created by admin on Sat Dec 16 18:31:15 GMT 2023 , Edited by admin on Sat Dec 16 18:31:15 GMT 2023

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PUBCHEM

90701378

Created by admin on Sat Dec 16 18:31:15 GMT 2023 , Edited by admin on Sat Dec 16 18:31:15 GMT 2023

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