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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 4635Generated: October 23, 2026

4a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano(1)benzofuro(3,2-e)isoquinolin-7(7aH)-one

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4a-Hydroxy-9-methoxy-3-methyl-2,3,4,4a,5,6-hexahydro-1H-4,12-methano(1)benzofuro(3,2-e)isoquinolin-7(7aH)-one molecular structure

Identifiers & Physical Properties

CAS No.850-50-0
Molecular formulaC18H21NO4
Average molar mass315.4 g/mol
Monoisotopic mass315.14705815 g/mol
SMILESCOc1ccc2c3c1OC1C(=O)CCC4(O)C(C2)N(C)CCC314
InChIKeyBRUQQQPBMZOVGD-UHFFFAOYSA-N
PubChem CID4635
DTXSIDDTXSID40859094

Chemical & Physical Properties

XLogP1.2
Topological polar surface area59
Hydrogen bond donors1
Hydrogen bond acceptors5
Rotatable bonds1
Heavy atoms23
Formal charge0
Complexity553
DrugsPharmaceuticals