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Details

Stereochemistry RACEMIC
Molecular Formula C19H29NO3
Molecular Weight 325.4761
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of D6-.BETA.-DIHYDROTETRABENAZINE

SMILES

CC(C)C[C@@]1([H])CN2CCc3cc(c(cc3[C@]2([H])C[C@@]1([H])O)OC([H])([H])[H])OC([H])([H])[H]

InChI

InChIKey=WEQLWGNDNRARGE-RXXFDNCFSA-N
InChI=1S/C19H29NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16-17,21H,5-7,10-11H2,1-4H3/t14-,16-,17+/m0/s1/i3D3,4D3

HIDE SMILES / InChI

Molecular Formula C19H29NO3
Molecular Weight 325.4761
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 Jun 26 01:00:28 UTC 2021
Edited
by admin
on Sat Jun 26 01:00:28 UTC 2021
Record UNII
AK7FUB0INQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
D6-.BETA.-DIHYDROTETRABENAZINE
Common Name English
REL-(2R,3S,11BS)-1,3,4,6,7,11B-HEXAHYDRO-9,10-DI(METHOXY-D3)-3-(2-METHYLPROPYL)-2H-BENZO(A)QUINOLIZIN-2-OL
Systematic Name English
(+/-)-.BETA.-DIHYDROTETRABENAZINE-D6
Common Name English
DEUTETRABENAZINE METABOLITE M5
Common Name English
2H-BENZO(A)QUINOLIZIN-2-OL, 1,3,4,6,7,11B-HEXAHYDRO-9,10-DI(METHOXY-D3)-3-(2-METHYLPROPYL)-, (2R,3S,11BS)-REL-
Systematic Name English
D6-.BETA.-HTBZ
Common Name English
(+/-)-D6-.BETA.-HTBZ
Common Name English
CIS (2,3)-DIHYDRO TETRABENAZINE-D6
Common Name English
SD-949
Code English
Code System Code Type Description
PUBCHEM
146014916
Created by admin on Sat Jun 26 01:00:28 UTC 2021 , Edited by admin on Sat Jun 26 01:00:28 UTC 2021
PRIMARY
FDA UNII
AK7FUB0INQ
Created by admin on Sat Jun 26 01:00:28 UTC 2021 , Edited by admin on Sat Jun 26 01:00:28 UTC 2021
PRIMARY
CAS
1351947-42-6
Created by admin on Sat Jun 26 01:00:28 UTC 2021 , Edited by admin on Sat Jun 26 01:00:28 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE