1-DEACETYLDIABOLINE MONOHYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H22N2O2.ClH
Molecular Weight	346.851
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-DEACETYLDIABOLINE MONOHYDROCHLORIDE

Structure Search

SMILES

Cl.O[C@@H]1OCC=C2C[N@@]3CC[C@@]45[C@@H]3C[C@@H]2[C@@H]1[C@@H]4NC6=CC=CC=C56

InChI

InChIKey=HZDOZEYLCKUWAZ-PDSDXOLYSA-N

InChI=1S/C19H22N2O2.ClH/c22-18-16-12-9-15-19(6-7-21(15)10-11(12)5-8-23-18)13-3-1-2-4-14(13)20-17(16)19;/h1-5,12,15-18,20,22H,6-10H2;1H/t12-,15-,16+,17-,18+,19+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C19H22N2O2
Molecular Weight	310.3902
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

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

Approval Year

PubMed

Title	Date	PubMed
Asparagine, valine, and threonine in the third extracellular loop of muscarinic receptor have essential roles in the positive cooperativity of strychnine-like allosteric modulators.	2005-05	15647330

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:34:17 GMT 2025` Edited by `admin` on `Mon Mar 31 22:34:17 GMT 2025`
Record UNII	B3J2CX8XHU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-DEACETYLDIABOLINE MONOHYDROCHLORIDE

Common Name

English

WIELAND-GUMLICH ALDEHYDE HYDROCHLORIDE

Preferred Name

English

DIABOLINE, 1-DEACETYL-, MONOHYDROCHLORIDE

Systematic Name

English

7,9-METHANO-7H-OXEPINO(3,4-A)PYRROLO(2,3-D)CARBAZOL-13-OL, 5,6,7A,8,8A,11,13,13A,13B,14-DECAHYDRO-, HYDROCHLORIDE (1:1), (4BS,7S,7AS,8AR,13R,13AR,13BS)-

Systematic Name

English

Code System Code Type Description

CAS

24182-78-3

Created by admin on Mon Mar 31 22:34:17 GMT 2025 , Edited by admin on Mon Mar 31 22:34:17 GMT 2025

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FDA UNII

B3J2CX8XHU

Created by admin on Mon Mar 31 22:34:17 GMT 2025 , Edited by admin on Mon Mar 31 22:34:17 GMT 2025

PRIMARY

PUBCHEM

162623938

Created by admin on Mon Mar 31 22:34:17 GMT 2025 , Edited by admin on Mon Mar 31 22:34:17 GMT 2025

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Related Record Type Details


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1-DEACETYLDIABOLINE

PARENT -> SALT/SOLVATE

Amount: