QUETTAMINE ION

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H22NO3
Molecular Weight	312.3829
Optical Activity	( + / - )
Defined Stereocenters	2 / 3
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C2O[C@@H]([C@@H]3C2=C(CC[N+]3(C)C)C=C1)C4=CC=C(O)C=C4

InChI

InChIKey=LQHAQKPJBTXMIP-ZWKOTPCHSA-O

InChI=1S/C19H21NO3/c1-20(2)11-10-12-6-9-15(22-3)19-16(12)17(20)18(23-19)13-4-7-14(21)8-5-13/h4-9,17-18H,10-11H2,1-3H3/p+1/t17-,18+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H21NO3
Molecular Weight	311.3749
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:21:30 GMT 2025` Edited by `admin` on `Mon Mar 31 23:21:30 GMT 2025`
Record UNII	8ZH40F1B0J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

QUETTAMINE ION

Common Name

English

2H-FURO(2,3,4-IJ)ISOQUINOLINIUM, 2A,3,4,5-TETRAHYDRO-2-(4-HYDROXYPHENYL)-8-METHOXY-3,3-DIMETHYL-, CIS-

Preferred Name

English

2H-FURO(2,3,4-IJ)ISOQUINOLINIUM, 2A,3,4,5-TETRAHYDRO-2-(4-HYDROXYPHENYL)-8-METHOXY-3,3-DIMETHYL-, (2R,2AS)-REL-

Systematic Name

English

QUETTAMINE, (±)-

Common Name

English

QUETTAMINE CATION

Common Name

English

QUETTAMINE

Common Name

English

Code System Code Type Description

PUBCHEM

5458828

Created by admin on Mon Mar 31 23:21:30 GMT 2025 , Edited by admin on Mon Mar 31 23:21:30 GMT 2025

PRIMARY

CAS

707536-13-8

Created by admin on Mon Mar 31 23:21:30 GMT 2025 , Edited by admin on Mon Mar 31 23:21:30 GMT 2025

ALTERNATIVE

CAS

77844-42-9

Created by admin on Mon Mar 31 23:21:30 GMT 2025 , Edited by admin on Mon Mar 31 23:21:30 GMT 2025

PRIMARY

FDA UNII

8ZH40F1B0J

Created by admin on Mon Mar 31 23:21:30 GMT 2025 , Edited by admin on Mon Mar 31 23:21:30 GMT 2025

PRIMARY

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