PROTOPINE METHIODIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H22NO5.I
Molecular Weight	495.3076
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[I-].C[N+]1(C)CCC2=CC3=C(OCO3)C=C2C(=O)CC4=C(C1)C5=C(OCO5)C=C4

InChI

InChIKey=JYALMTAKUAXGEL-UHFFFAOYSA-M

InChI=1S/C21H22NO5.HI/c1-22(2)6-5-14-8-19-20(26-11-25-19)9-15(14)17(23)7-13-3-4-18-21(16(13)10-22)27-12-24-18;/h3-4,8-9H,5-7,10-12H2,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C21H22NO5
Molecular Weight	368.4031
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	HI
Molecular Weight	127.91241
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:34:17 GMT 2025` Edited by `admin` on `Mon Mar 31 21:34:17 GMT 2025`
Record UNII	2687ADU1SX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7,13A-SECOBERBINIUM, 7,7-DIMETHYL-2,3:9,10-BIS(METHYLENEDIOXY)-13A-OXO-, IODIDE

Preferred Name

English

PROTOPINE METHIODIDE

Common Name

English

BIS(1,3)BENZODIOXOLO(4,5-C:5',6'-G)AZECINIUM, 4,5,6,7,13,14-HEXAHYDRO-5,5-DIMETHYL-13-OXO-, IODIDE (1:1)

Systematic Name

English

PROTOPINE METHIODIDE [MI]

Common Name

English

BIS(1,3)BENZODIOXOLO(4,5-C:5',6'-G)AZECINIUM, 4,5,6,7,13,14-HEXAHYDRO-5,5-DIMETHYL-13-OXO-, IODIDE

Systematic Name

English

Code System Code Type Description

CAS

6164-50-7