Enacyloxin IIa; 13'-Me ether

AlkaPlorer ID: AK297421

Synonym: None

IUPAC Name: None

Structure

SMILES: CC/C=C/C(OC(N)=O)C(Cl)C(O)CC(=O)C(O)C(OC)C(C)/C(Cl)=C/C=C\C=C(C)\C=C\C=C/C(=O)OC1CC(C(=O)O)CCC1O

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InChI: InChI=1S/C34H47Cl2NO11/c1-5-6-14-27(48-34(37)45)30(36)25(39)19-26(40)31(42)32(46-4)21(3)23(35)13-9-7-11-20(2)12-8-10-15-29(41)47-28-18-22(33(43)44)16-17-24(28)38/h6-15,21-22,24-25,27-28,30-32,38-39,42H,5,16-19H2,1-4H3,(H2,37,45)(H,43,44)/b9-7-,12-8+,14-6+,15-10-,20-11+,23-13-

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InChIKey: WKINVJVPTADRQH-FCPNKLHESA-N

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Reference

CAS: 165337-91-7

Source

Properties Information

Molecule Weight: 716.6520000000002

TPSA: 202.91

MolLogP: 4.251000000000005

Number of H-Donors: 5

Number of H-Acceptors: 10

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information