Oxobuxifoline

AlkaPlorer ID: AK101261

Synonym: ''

IUPAC Name: 7,16-dimethoxy-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1,6,8(20),9,11,14(19),15,17-octaen-13-one

Structure

SMILES: COC1=CC=C2C(=C1)C(=O)C1=NC=CC3=C(OC)C4=C(OCO4)C2=C13

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InChI: InChI=1S/C19H13NO5/c1-22-9-3-4-10-12(7-9)16(21)15-13-11(5-6-20-15)17(23-2)19-18(14(10)13)24-8-25-19/h3-7H,8H2,1-2H3

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InChIKey: COZVCMSRTUAQHU-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 335.3150000000001

TPSA: 66.88000000000001

MolLogP: 3.1921000000000017

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information