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Chemical structure of Toralactone

GC61338

Toralactone

Also known as 1,10-dihydroxy-7-methoxy-3-methylbenzo[g]isochromen-9-one

Toralactone, isolated from Cassia obtusifolia, mediates hepatoprotection via an Nrf2-dependent anti-oxidative mechanism

ChemicalCAS41743-74-2MW272.25FormulaC15H12O5
CAS number
41743-74-2
Molecular weight
272.25
Formula
C15H12O5
InChIKey
NFNQIVIXHYXLPG-UHFFFAOYSA-N
Catalogue number
GC61338
Brand
GLPBIO
Computed properties PubChem CID 162484 · XLogP 1.2 · TPSA 76 Ų · H-bond donors 2
XLogP
1.2
TPSA
76 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
20

SMILES CC1=CC2=CC3=CC(=CC(=O)C3=C(C2=C(O1)O)O)OC

Computed descriptors from PubChem (CID 162484), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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