6,8-di-O-acetylmalyngamide 2

AlkaPlorer ID: AK001346

Synonym: None

IUPAC Name: [(1S,3R,4S,5S)-5-acetyloxy-3-[(E)-1-chloro-3-[[(E,7S)-7-methoxytetradec-4-enoyl]amino]prop-1-en-2-yl]-4-hydroxy-4-methyl-2-oxocyclohexyl] acetate

Structure

SMILES: CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C/Cl)[C@H]1C(=O)[C@@H](OC(C)=O)C[C@H](OC(C)=O)[C@@]1(C)O)OC

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InChI: InChI=1S/C29H46ClNO8/c1-6-7-8-9-11-14-23(37-5)15-12-10-13-16-26(34)31-19-22(18-30)27-28(35)24(38-20(2)32)17-25(29(27,4)36)39-21(3)33/h10,12,18,23-25,27,36H,6-9,11,13-17,19H2,1-5H3,(H,31,34)/b12-10+,22-18-/t23-,24-,25-,27-,29+/m0/s1

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InChIKey: VCYLDGFZBOWHOI-XZALHDRTSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
None Cyanobacterium Geminocystaceae Chroococcales Cyanophyceae Cyanobacteriota None Bacteria

Properties Information

Molecule Weight: 572.1390000000004

TPSA: 128.23000000000002

MolLogP: 4.530700000000005

Number of H-Donors: 2

Number of H-Acceptors: 8

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information