Molecular Identity
8-Methoxypsoralen
9-methoxyfuro[3,2-g]chromen-7-one
PubChem CID: 4114
8-Methoxypsoralen with ultraviolet A therapy can cause cancer according to California Labor Code.
2D Structure
Properties
C12H8O4
Molecular Formula
216.19
Molecular Weight
g/mol
216.0423
Exact Mass
Da
1.9
XLogP
Drug-like (Lipinski: < 5)
48.7
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
4
H-Bond Acceptors
325
Complexity
SMILES
Canonical SMILES
SMILES: COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2Isomeric SMILES
SMILES: COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2Synonyms(20)
methoxsalen8-Methoxypsoralen298-81-7XANTHOTOXIN8-MOPOxsoralen9-Methoxy-7H-furo[3,2-g]chromen-7-oneMeladinineOxypsoralenMeloxinePuvalenXanthotoxineAmmoidinMeladininMeladoxen
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 8-Methoxypsoralen
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