Vermisporin

AlkaPlorer ID: AK317508

Synonym: None

IUPAC Name: 3-[[2-(2,3-dimethyloxiran-2-yl)-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxymethylidene]-1-methyl-5-propan-2-ylpyrrolidine-2,4-dione

Structure

SMILES: CC1CC(C)C2C(C=CC(C3(C)OC3C)C2C(O)=C2C(=O)C(C(C)C)N(C)C2=O)C1

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InChI: InChI=1S/C25H37NO4/c1-12(2)21-23(28)20(24(29)26(21)7)22(27)19-17(25(6)15(5)30-25)9-8-16-11-13(3)10-14(4)18(16)19/h8-9,12-19,21,27H,10-11H2,1-7H3

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InChIKey: OBDFYDGODWWFEX-UHFFFAOYSA-N

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Reference

PubChem CID: 76172940

CAS: 122301-98-8

Properties Information

Molecule Weight: 415.5740000000002

TPSA: 70.14

MolLogP: 4.142200000000003

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information