Gladiostatin

AlkaPlorer ID: AK327740

Synonym: None

IUPAC Name: 4-[(E)-2-hydroxy-16-(2-hydroxy-3-methyl-5-oxo-2H-furan-4-yl)-5-methyl-4,16-dioxohexadec-6-enyl]piperidine-2,6-dione

Structure

SMILES: CC1=C(C(=O)CCCCCCCC/C=C/C(C)C(=O)CC(O)CC2CC(=O)NC(=O)C2)C(=O)OC1O

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InChI: InChI=1S/C27H39NO8/c1-17(22(31)16-20(29)13-19-14-23(32)28-24(33)15-19)11-9-7-5-3-4-6-8-10-12-21(30)25-18(2)26(34)36-27(25)35/h9,11,17,19-20,26,29,34H,3-8,10,12-16H2,1-2H3,(H,28,32,33)/b11-9+

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InChIKey: SYADJZZKJSIWKK-PKNBQFBNSA-N

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Properties Information

Molecule Weight: 505.6080000000004

TPSA: 147.07

MolLogP: 2.823300000000001

Number of H-Donors: 3

Number of H-Acceptors: 8

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information