Platensimycin A2

AlkaPlorer ID: AK017921

Synonym: None

IUPAC Name: 2,4-dihydroxy-3-[3-[(1R,5S,7S,9S,11R)-11-hydroxy-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.17,10.01,6]tridec-2-en-5-yl]propanoylamino]benzoic acid

Structure

SMILES: C[C@]12C[C@@]34C=CC(=O)[C@@](C)(CCC(O)=NC5=C(O)C=CC(C(=O)O)=C5O)C3[C@H](CC1[C@H]4O)O2

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InChI: InChI=1S/C24H27NO8/c1-22(7-6-16(28)25-17-13(26)4-3-11(18(17)29)21(31)32)15(27)5-8-24-10-23(2)12(20(24)30)9-14(33-23)19(22)24/h3-5,8,12,14,19-20,26,29-30H,6-7,9-10H2,1-2H3,(H,25,28)(H,31,32)/t12?,14-,19?,20+,22+,23-,24-/m0/s1

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InChIKey: VAAYQILRAJLVSM-IFXSOFCXSA-N

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Source

Properties Information

Molecule Weight: 457.47900000000016

TPSA: 156.88

MolLogP: 2.8540000000000005

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information