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Chemical structure of Isomucronulatol

GC39099

Isomucronulatol

Also known as 3-(2-hydroxy-3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromen-7-ol

Isomucronulatol is a flavonoid isolated from the roots of A

ChemicalCAS52250-35-8MW302.32FormulaC17H18O5
CAS number
52250-35-8
Molecular weight
302.32
Formula
C17H18O5
Solubility
DMSO ： 100 mg/mL (330·78 mM; Need ultrasonic)
InChIKey
NQRBAPDEZYMKFL-UHFFFAOYSA-N
Catalogue number
GC39099
Brand
GLPBIO
Computed properties PubChem CID 602152 · XLogP 2.9 · TPSA 68.2 Ų · H-bond donors 2
XLogP
2.9
TPSA
68.2 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
22

SMILES COC1=C(C(=C(C=C1)C2CC3=C(C=C(C=C3)O)OC2)O)OC

Computed descriptors from PubChem (CID 602152), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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