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Chemical structure of Sophocarpine monohydrate

GC64223

Sophocarpine monohydrate

Also known as (1R,2R,9S,17S)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-6-one;hydrate

Sophocarpine (monohydrate) is one of the significant alkaloid extracted from the traditional herb medicine Sophora flavescens which has many pharmacological properties such as anti-virus, anti-tumor, anti-inflammatory

ChemicalCAS145572-44-7MW264.36FormulaC15H24N2O2
CAS number
145572-44-7
Molecular weight
264.36
Formula
C15H24N2O2
Solubility
DMSO ： 100 mg/mL (378·27 mM; Need ultrasonic)
InChIKey
FBOREIYHDGYUFA-PUILLJIJSA-N
Catalogue number
GC64223
Brand
GLPBIO
Computed properties PubChem CID 71748607 · TPSA 24.6 Ų · H-bond donors 1 · H-bond acceptors 3
TPSA
24.6 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
19

SMILES C1C[C@H]2CN3[C@H](CC=CC3=O)[C@@H]4[C@H]2N(C1)CCC4.O

Computed descriptors from PubChem (CID 71748607), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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