N-acetylaureothamine

AlkaPlorer ID: AK326212

Synonym: None

IUPAC Name: N-[4-[(E,3Z)-3-[5-(6-methoxy-3,5-dimethyl-4-oxopyran-2-yl)oxolan-3-ylidene]-2-methylprop-1-enyl]phenyl]acetamide

Structure

SMILES: COC1=C(C)C(=O)C(C)=C(C2C/C(=C/C(C)=C/C3=CC=C(N=C(C)O)C=C3)CO2)O1

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InChI: InChI=1S/C24H27NO5/c1-14(10-18-6-8-20(9-7-18)25-17(4)26)11-19-12-21(29-13-19)23-15(2)22(27)16(3)24(28-5)30-23/h6-11,21H,12-13H2,1-5H3,(H,25,26)/b14-10+,19-11-

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InChIKey: ZTZOKXOFRGHKSG-YPJQUURKSA-N

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Source

Properties Information

Molecule Weight: 409.48200000000014

TPSA: 81.26

MolLogP: 5.364440000000005

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information