(12S,13R)-N-acetyl-dihydroxylanomycin

AlkaPlorer ID: AK141111

Synonym: None

IUPAC Name: [(2S,3R,4S,5S)-2-[(2E,4E,6S,7R)-6,7-dihydroxyocta-2,4-dien-2-yl]-4-methoxy-5-methyloxan-3-yl] 2-acetamidoacetate

Structure

SMILES: CO[C@@H]1[C@@H](OC(=O)CNC(C)=O)[C@H](/C(C)=C/C=C/[C@H](O)[C@@H](C)O)OC[C@@H]1C

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InChI: InChI=1S/C19H31NO7/c1-11(7-6-8-15(23)13(3)21)18-19(17(25-5)12(2)10-26-18)27-16(24)9-20-14(4)22/h6-8,12-13,15,17-19,21,23H,9-10H2,1-5H3,(H,20,22)/b8-6+,11-7+/t12-,13+,15-,17-,18-,19+/m0/s1

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InChIKey: RJLXEVMSZRQSPQ-TZVBAZFCSA-N

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Source

Properties Information

Molecule Weight: 385.45700000000016

TPSA: 114.32

MolLogP: 0.3284000000000016

Number of H-Donors: 3

Number of H-Acceptors: 7

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information