Narcotinediol; 13-Ac

AlkaPlorer ID: AK307433

Synonym: Papaveroxinoline

IUPAC Name: [[2-(hydroxymethyl)-3,4-dimethoxyphenyl]-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl] acetate

Structure

SMILES: COC1=CC=C(C(OC(C)=O)C2C3=C(OC)C4=C(C=C3CCN2C)OCO4)C(CO)=C1OC

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InChI: InChI=1S/C24H29NO8/c1-13(27)33-22(15-6-7-17(28-3)21(29-4)16(15)11-26)20-19-14(8-9-25(20)2)10-18-23(24(19)30-5)32-12-31-18/h6-7,10,20,22,26H,8-9,11-12H2,1-5H3

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InChIKey: HHJKQBLXEZPDNY-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 459.4950000000004

TPSA: 95.92000000000002

MolLogP: 2.766800000000001

Number of H-Donors: 1

Number of H-Acceptors: 9

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information