Zygosporin D; 21-Ac

AlkaPlorer ID: AK318175

Synonym: Cytochalasin D, Zygosporin A

IUPAC Name: (16-benzyl-5,12-dihydroxy-5,7,14-trimethyl-13-methylidene-6,18-dioxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9-dien-2-yl) acetate

Structure

SMILES: C=C1C(C)C2C(CC3=CC=CC=C3)N=C(O)C23C(OC(C)=O)C=CC(C)(O)C(=O)C(C)CC=CC3C1O

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InChI: InChI=1S/C30H37NO6/c1-17-10-9-13-22-26(33)19(3)18(2)25-23(16-21-11-7-6-8-12-21)31-28(35)30(22,25)24(37-20(4)32)14-15-29(5,36)27(17)34/h6-9,11-15,17-18,22-26,33,36H,3,10,16H2,1-2,4-5H3,(H,31,35)

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InChIKey: SDZRWUKZFQQKKV-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 507.6270000000003

TPSA: 116.42

MolLogP: 3.757400000000004

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information