Henderine

AlkaPlorer ID: AK300136

Synonym: None

IUPAC Name: None

Structure

SMILES: CC(=O)N1CCC2=CC3=C(OCO3)C3=C2C1=CC1=CC=C2OCOC2=C1O3

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InChI: InChI=1S/C20H15NO6/c1-10(22)21-5-4-11-7-15-19(26-9-24-15)20-16(11)13(21)6-12-2-3-14-18(17(12)27-20)25-8-23-14/h2-3,6-7H,4-5,8-9H2,1H3

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InChIKey: FDWYUUQZSZSLRI-UHFFFAOYSA-N

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Reference

CAS: 102686-11-3

Source

Properties Information

Molecule Weight: 365.3410000000001

TPSA: 66.46000000000001

MolLogP: 3.152400000000002

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information