SD-1027

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H27NO5
Molecular Weight	349.4214
Optical Activity	( + / - )
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC2=C(C=C1OC)[C@H]3C[C@H](O)[C@H](C[C@@H](C)C(O)=O)CN3CC2

InChI

InChIKey=YKUYTZDBKXGBRU-CUBALJKWSA-N

InChI=1S/C19H27NO5/c1-11(19(22)23)6-13-10-20-5-4-12-7-17(24-2)18(25-3)8-14(12)15(20)9-16(13)21/h7-8,11,13,15-16,21H,4-6,9-10H2,1-3H3,(H,22,23)/t11-,13-,15-,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H27NO5
Molecular Weight	349.4214
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 13:42:26 UTC 2023` Edited by `admin` on `Sat Dec 16 13:42:26 UTC 2023`
Record UNII	3G7675CL5A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SD-1027

Code

English

(R)-3-((2S,3R,11BR)-2-HYDROXY-9,10-DIMETHOXY-1,3,4,6,7,11B-HEXAHYDRO-2H-PYRIDO(2,1-A)ISOQUINOLIN-3-YL)-2-METHYLPROPANOIC ACID

Systematic Name

English

TETRABENAZINE METABOLITE M1

Common Name

English

Code System Code Type Description

FDA UNII

3G7675CL5A

Created by admin on Sat Dec 16 13:42:26 UTC 2023 , Edited by admin on Sat Dec 16 13:42:26 UTC 2023

PRIMARY

PUBCHEM

122415175

Created by admin on Sat Dec 16 13:42:26 UTC 2023 , Edited by admin on Sat Dec 16 13:42:26 UTC 2023

PRIMARY

Related Record Type Details


					Z9O08YRN8O

TETRABENAZINE

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