Compound ID | 3428

Update compound information

Polyketomycin

Class: Natural product antibiotic

Agent Type: Natural product; Small molecule;
Spectrum of activity: Gram-positive
Mechanism of action: Unknown
Target Pathogen: Active against methicillin-resistant and -susceptible Staphylococcus aureus, and Corynebacterium bovis
Description: Natural product from Streptomyces sp.; also shows anti-tumour properties
Year first mentioned: 1998
Development status: Experimental
Chemical structure(s):
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Molecular weight: 864.84
Iso. SMILES: COC1=CC(=O)c2c(O)c3C(=O)C4(O)C(=O)C(=C(C)O)C(=O)C(O[C@H]5CC[C@H](O[C@H]6C[C@@](C)(O)[C@H](OC(=O)c7c(C)ccc(C)c7O)[C@H](C)O6)[C@@H](C)O5)C4(O)Cc3c(C)c2C1=O
InChI Key: OWRCRVABZYJUES-SPJHXACWSA-N
Can. SMILES: CC1=CC=C(C)C(=C1C(=O)O[C@@H]2[C@H](C)O[C@H](C[C@@]2(C)O)O[C@H]3CC[C@@H](O[C@@H]3C)OC4C(=O)C(=C(C)O)C(=O)C5(C(=O)C6=C(CC45O)C(=C7C(=C6O)C(=O)C=C(C7=O)OC)C)O)O
InChI: InChI=1S/C44H48O18/c1-16-9-10-17(2)33(47)28(16)41(53)62-39-21(6)59-27(15-42(39,7)54)60-24-11-12-26(58-20(24)5)61-40-36(50)30(19(4)45)37(51)44(56)38(52)31-22(14-43(40,44)55)18(3)29-32(35(31)49)23(46)13-25(57-8)34(29)48/h9-10,13,20-21,24,26-27,39-40,45,47,49,54-56H,11-12,14-15H2,1-8H3/t20-,21+,24+,26+,27+,39-,40?,42-,43?,44?/m1/s1
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/substance/274800406
Citation: https://www.jstage.jst.go.jp/article/antibiotics1968/51/1/51_1_21/_article/-char/en

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