CUPREINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H22N2O2
Molecular Weight	310.3902
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@@H]([C@@H]1C[C@@H]2CC[N@]1C[C@@H]2C=C)C3=C4C=C(O)C=CC4=NC=C3

InChI

InChIKey=VJFMSYZSFUWQPZ-BIPCEHGGSA-N

InChI=1S/C19H22N2O2/c1-2-12-11-21-8-6-13(12)9-18(21)19(23)15-5-7-20-17-4-3-14(22)10-16(15)17/h2-5,7,10,12-13,18-19,22-23H,1,6,8-9,11H2/t12-,13-,18-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H22N2O2
Molecular Weight	310.3902
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 `Mon Mar 31 20:58:20 GMT 2025` Edited by `admin` on `Mon Mar 31 20:58:20 GMT 2025`
Record UNII	73J76E056V
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CUPREINE

Common Name

English

(8.ALPHA.,9R)-CINCHONAN-6',9-DIOL

Preferred Name

English

O-DEMETHYLQUININE

Common Name

English

CINCHONAN-6',9-DIOL, (8.ALPHA.,9R)-

Common Name

English

DESMETHYLQUININE

Common Name

English

CUPREINE [MI]

Common Name

English

O6'-DEMETHYLQUININE

Common Name

English

ULTRAQUININE

Common Name

English

6'-HYDROXYCINCHONIDINE

Common Name

English

Code System Code Type Description

FDA UNII

73J76E056V