8,9-dihydrolactimidomycin

AlkaPlorer ID: AK045039

Synonym: None

IUPAC Name: 4-[(E,2R,5S)-2-hydroxy-5-methyl-7-[(2R,3S,6E,10E)-3-methyl-12-oxo-1-oxacyclododeca-6,10-dien-2-yl]-4-oxooct-6-enyl]piperidine-2,6-dione

Structure

SMILES: C/C(=C\[C@H](C)C(=O)C[C@H](O)CC1CC(=O)N=C(O)C1)[C@@H]1OC(=O)/C=C/CC/C=C/CC[C@@H]1C

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InChI: InChI=1S/C26H37NO6/c1-17-10-8-6-4-5-7-9-11-25(32)33-26(17)19(3)12-18(2)22(29)16-21(28)13-20-14-23(30)27-24(31)15-20/h4,6,9,11-12,17-18,20-21,26,28H,5,7-8,10,13-16H2,1-3H3,(H,27,30,31)/b6-4+,11-9+,19-12+/t17-,18-,21+,26+/m0/s1

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InChIKey: JMMMWKAJHBCSAV-XZBFPPINSA-N

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Properties Information

Molecule Weight: 459.5830000000003

TPSA: 113.26

MolLogP: 4.406400000000004

Number of H-Donors: 2

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information