Compound ID | 3116

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Aurantinin

Synonym(s): Antibiotic KM-214  |  KM-214

Class: Membrane-active agent

Agent Type: Natural product; Small molecule; Direct acting;
Spectrum of activity: Gram-positive
Mechanism of action: Membrane-active agent
Target Pathogen: Active against Staphylococcus aureus, Bacillus anthracis, and Corynebacterium paurometabolum
Description: Natural product from Bacillus aurantinus (also by Bacillus subtilis);
Year first mentioned: 1976
Development status: Experimental
Chemical structure(s):
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Molecular weight: 678.9
Iso. SMILES: CC1CCC2C(C1O)C=C(C(/C/3=C/4\C(C(C\C4=C(\C(=O)OC(=O)C23)/C)O)C)/C=C/C=C/C=C(\C)/CC(C)CC(C)CC(C(C)C(=O)O)O)C
InChI Key: JJIRJXPAKWKETG-PKBBRYSMSA-N
Can. SMILES: C/C(=C\C=C\C=C\C/1C(=CC2C(CCC(C)C2O)C3\C1=C/4\C(C)C(C\C4=C(/C)\C(=O)OC3=O)O)C)/CC(C)CC(C)CC(C(C)C(=O)O)O
InChI: InChI=1S/C41H58O8/c1-21(16-22(2)17-23(3)18-33(42)28(8)39(45)46)12-10-9-11-13-29-25(5)19-32-30(15-14-24(4)38(32)44)37-36(29)35-27(7)34(43)20-31(35)26(6)40(47)49-41(37)48/h9-13,19,22-24,27-30,32-34,37-38,42-44H,14-18,20H2,1-8H3,(H,45,46)/b10-9+,13-11+,21-12+,31-26-,36-35-
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/124201465
Citations:
  • https://www.nature.com/articles/s41467-021-24846-7#Sec1
  • https://www.jstage.jst.go.jp/article/antibiotics1968/29/4/29_4_477/_article/-char/en

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