Colletotrichamide C

AlkaPlorer ID: AK326616

Synonym: None

IUPAC Name: 6-benzyl-3-butan-2-yl-10-hydroxy-4-methyl-12-[(7R)-7-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctan-2-yl]-1-oxa-4,7-diazacyclododecane-2,5,8-trione

Structure

SMILES: CCC(C)C1C(=O)OC(C(C)CCCC[C@@H](C)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)CC(O)CC(O)=NC(CC2=CC=CC=C2)C(=O)N1C

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InChI: InChI=1S/C35H56N2O11/c1-6-20(2)29-34(45)47-26(17-24(39)18-28(40)36-25(33(44)37(29)5)16-23-14-8-7-9-15-23)21(3)12-10-11-13-22(4)46-35-32(43)31(42)30(41)27(19-38)48-35/h7-9,14-15,20-22,24-27,29-32,35,38-39,41-43H,6,10-13,16-19H2,1-5H3,(H,36,40)/t20?,21?,22-,24?,25?,26?,27-,29?,30-,31+,32+,35-/m1/s1

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InChIKey: HPPUILYZIHIGQH-OKMZIMIASA-N

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Properties Information

Molecule Weight: 680.836

TPSA: 198.81

MolLogP: 1.8953000000000029

Number of H-Donors: 6

Number of H-Acceptors: 11

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information