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Chemical structure of Isopropylidenylacetyl-marmesin

GC36337

Isopropylidenylacetyl-marmesin

Also known as 2-(7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl)propan-2-yl 3-methylbut-2-enoate

Isopropylidenylacetyl-marmesin ((±)-Prantschimgin) is a coumarin isolated from the roots of F

ChemicalCAS35178-20-2MW328.36FormulaC19H20O5
CAS number
35178-20-2
Molecular weight
328.36
Formula
C19H20O5
Solubility
Soluble in DMSO
InChIKey
PQCLZBCFLJVBGA-UHFFFAOYSA-N
Catalogue number
GC36337
Brand
GLPBIO
Computed properties PubChem CID 4269891 · XLogP 3.9 · TPSA 61.8 Ų · H-bond donors 0
XLogP
3.9
TPSA
61.8 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24

SMILES CC(=CC(=O)OC(C)(C)C1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)C

Computed descriptors from PubChem (CID 4269891), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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