Platensimycin A5

AlkaPlorer ID: AK017843

Synonym: None

IUPAC Name: 2,4-dihydroxy-3-[3-[(1S,5S,10S)-10-hydroxy-10-(hydroxymethyl)-5-methyl-4-oxo-5-tricyclo[7.2.1.01,6]dodec-2-enyl]propanoylamino]benzoic acid

Structure

SMILES: C[C@@]1(CCC(O)=NC2=C(O)C=CC(C(=O)O)=C2O)C(=O)C=C[C@@]23CC(CCC21)[C@](O)(CO)C3

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InChI: InChI=1S/C24H29NO8/c1-22(8-7-18(29)25-19-15(27)4-3-14(20(19)30)21(31)32)16-5-2-13-10-23(16,9-6-17(22)28)11-24(13,33)12-26/h3-4,6,9,13,16,26-27,30,33H,2,5,7-8,10-12H2,1H3,(H,25,29)(H,31,32)/t13?,16?,22-,23-,24+/m0/s1

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InChIKey: DOYWTHZZLFTNQH-DFOWYGNBSA-N

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Source

Properties Information

Molecule Weight: 459.4950000000004

TPSA: 167.88

MolLogP: 2.8392000000000017

Number of H-Donors: 6

Number of H-Acceptors: 7

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information