Hydroxypseudomonic acid-C amide

AlkaPlorer ID: AK075661

Synonym: None

IUPAC Name: [8-oxo-8-[(2-oxopiperidin-3-yl)amino]octyl] (E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(E,4R,5S)-5-hydroxy-4-methylhex-2-enyl]oxan-2-yl]-4-hydroxy-3-methylbut-2-enoate

Structure

SMILES: C/C(=C\C(=O)OCCCCCCCC(O)=NC1CCCN=C1O)C(O)[C@@H]1OC[C@H](C/C=C/[C@@H](C)[C@H](C)O)[C@@H](O)[C@H]1O

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InChI: InChI=1S/C30H50N2O9/c1-19(21(3)33)11-9-12-22-18-41-29(28(38)27(22)37)26(36)20(2)17-25(35)40-16-8-6-4-5-7-14-24(34)32-23-13-10-15-31-30(23)39/h9,11,17,19,21-23,26-29,33,36-38H,4-8,10,12-16,18H2,1-3H3,(H,31,39)(H,32,34)/b11-9+,20-17+/t19-,21+,22+,23?,26?,27-,28-,29+/m1/s1

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InChIKey: BJKYLYDPTXLFIC-IIJHPWTMSA-N

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Source

Properties Information

Molecule Weight: 582.7350000000005

TPSA: 181.63

MolLogP: 2.952800000000002

Number of H-Donors: 6

Number of H-Acceptors: 9

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information