D3-10-O-DESMETHYL-.ALPHA.-DIHYDROTETRABENAZINE

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H27NO3
Molecular Weight	308.4304
Optical Activity	( + / - )
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of D3-10-O-DESMETHYL-.ALPHA.-DIHYDROTETRABENAZINE

Structure Search

SMILES

[2H]C([2H])([2H])OC1=C(O)C=C2[C@H]3C[C@@H](O)[C@H](CC(C)C)CN3CCC2=C1

InChI

InChIKey=QPCCFQGYORNUSE-NPPLBYTGSA-N

InChI=1S/C18H27NO3/c1-11(2)6-13-10-19-5-4-12-7-18(22-3)17(21)8-14(12)15(19)9-16(13)20/h7-8,11,13,15-16,20-21H,4-6,9-10H2,1-3H3/t13-,15-,16-/m1/s1/i3D3

HIDE SMILES / InChI

Molecular Formula	C18H27NO3
Molecular Weight	308.4304
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 13:55:32 GMT 2023` Edited by `admin` on `Sat Dec 16 13:55:32 GMT 2023`
Record UNII	YM7VES1KLY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

D3-10-O-DESMETHYL-.ALPHA.-DIHYDROTETRABENAZINE

Common Name

English

SD-976

Code

English

D3-10-O-DESMETHYL-.ALPHA.-HTBZ

Common Name

English

REL-(2R,3R,11BR)-3-ISOBUTYL-9-(METHOXY-D3)-1,3,4,6,7,11B-HEXAHYDRO-2H-PYRIDO(2,1-A)ISOQUINOLINE-2,10-DIOL

Systematic Name

English

Code System Code Type Description

FDA UNII

YM7VES1KLY

Created by admin on Sat Dec 16 13:55:32 GMT 2023 , Edited by admin on Sat Dec 16 13:55:32 GMT 2023

PRIMARY

PUBCHEM

146019563

Created by admin on Sat Dec 16 13:55:32 GMT 2023 , Edited by admin on Sat Dec 16 13:55:32 GMT 2023

PRIMARY

Related Record Type Details


					P341G6W9NB

DEUTETRABENAZINE

PARENT -> METABOLITE

Amount: