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Chemical structure of Dehydroevodiamine (hydrochloride)

GC43405

Dehydroevodiamine (hydrochloride)

Also known as 21-methyl-3,13,21-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,3,5,7,9,15,17,19-octaen-14-one;hydrochloride

Dehydroevodiamine is an alkaloid that has been isolated from E

ChemicalCAS111664-82-5MW337.8FormulaC19H15N3O•HCl
CAS number
111664-82-5
Molecular weight
337.8
Formula
C19H15N3O•HCl
Solubility
DMF： 2·5 mg/ml,DMSO： 12·5 mg/ml,Ethanol： 2·5 mg/ml
InChIKey
SVOMSEHNGXLQRU-UHFFFAOYSA-N
Catalogue number
GC43405
Brand
GLPBIO
Computed properties PubChem CID 135393457 · TPSA 35.9 Ų · H-bond donors 1 · H-bond acceptors 3
TPSA
35.9 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
24

SMILES CN1C2=CC=CC=C2C(=O)N3C1=C4C(=C5C=CC=CC5=N4)CC3.Cl

Computed descriptors from PubChem (CID 135393457), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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