PALMATINE CHLORIDE MONOHYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H22NO4.Cl.H2O
Molecular Weight	405.872
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PALMATINE CHLORIDE MONOHYDRATE

Structure Search

SMILES

O.[Cl-].COC1=CC2=C(C=C1OC)C3=[N+](CC2)C=C4C(C=CC(OC)=C4OC)=C3

InChI

InChIKey=PIQNSCSNSSZUIT-UHFFFAOYSA-M

InChI=1S/C21H22NO4.ClH.H2O/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4;;/h5-6,9-12H,7-8H2,1-4H3;1H;1H2/q+1;;/p-1

HIDE SMILES / InChI

Molecular Formula	C21H22NO4
Molecular Weight	352.4037
Charge	1
Count

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

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	HO
Molecular Weight	17.0073
Charge	-1
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 `Sat Dec 16 10:56:24 UTC 2023` Edited by `admin` on `Sat Dec 16 10:56:24 UTC 2023`
Record UNII	ZMR2H7M7PK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PALMATINE CHLORIDE MONOHYDRATE

Common Name

English

DIBENZO(A,G)QUINOLIZINIUM, 5,6-DIHYDRO-2,3,9,10-TETRAMETHOXY-, CHLORIDE, HYDRATE (1:1:1)

Systematic Name

English

DIBENZO(A,G)QUINOLIZINIUM, 5,6-DIHYDRO-2,3,9,10-TETRAMETHOXY-, CHLORIDE, MONOHYDRATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID1047869

Created by admin on Sat Dec 16 10:56:25 UTC 2023 , Edited by admin on Sat Dec 16 10:56:25 UTC 2023

PRIMARY

PUBCHEM

16212317

Created by admin on Sat Dec 16 10:56:25 UTC 2023 , Edited by admin on Sat Dec 16 10:56:25 UTC 2023

PRIMARY

CAS

171869-95-7

Created by admin on Sat Dec 16 10:56:25 UTC 2023 , Edited by admin on Sat Dec 16 10:56:25 UTC 2023

PRIMARY

FDA UNII

ZMR2H7M7PK

Created by admin on Sat Dec 16 10:56:25 UTC 2023 , Edited by admin on Sat Dec 16 10:56:25 UTC 2023

PRIMARY

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