Curacin E

AlkaPlorer ID: AK293350

Synonym: None

IUPAC Name: 5-methoxy-15-[2-(2-methylcyclopropyl)-4,5-dihydro-1,3-thiazol-4-yl]pentadeca-8,10,14-trien-3-one

Structure

SMILES: CCC(=O)CC(CCC=CC=CCCC=CC1CSC(C2CC2C)=N1)OC

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InChI: InChI=1S/C23H35NO2S/c1-4-20(25)16-21(26-3)14-12-10-8-6-5-7-9-11-13-19-17-27-23(24-19)22-15-18(22)2/h5-6,8,10-11,13,18-19,21-22H,4,7,9,12,14-17H2,1-3H3

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InChIKey: AVQWMIOFPQCRNF-UHFFFAOYSA-N

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Reference

PubChem CID: 163107298

COCONUT: CNP0427264.1

Source

Properties Information

Molecule Weight: 389.6050000000001

TPSA: 38.66

MolLogP: 5.769500000000006

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information