Compound ID | 1683

Update compound information

Geninthiocin (Ala-geninthiocin analog)

Class: Antimicrobial peptide (thiopeptide)

Spectrum of activity: Gram-positive
Description: Natural product from marine Streptomyces sp. ICN19
Institute where first reported: International Centre for Nanobiotechnology, India
Year first mentioned: 2018
Highest developmental phase: Preclinical
Chemical structure(s):
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Molecular weight: 1132.08
Iso. SMILES: C/C=C/1\C2=NC(=CO2)C(=O)NC(=C)C(=O)NC(C(=O)NC(=C)C3=NC(=C(O3)C)C(=O)NC(=C)C(=O)NC(=C)C4=NC(=CO4)C5=C(C=CC(=N5)C(=O)NC(=C)C(=O)NC(=C)C(=O)N)C6=NC(=CS6)C(=O)NC(C(=O)N1)C(C)O)C(C)(C)O
InChI Key: JNUIXQXFKIJDIV-KKMKTNMSSA-N
Can. SMILES: C/C=C/1\C2=NC(=CO2)C(=O)NC(=C)C(=O)NC(C(=O)NC(=C)C3=NC(=C(C)O3)C(=O)NC(=C)C(=O)NC(=C)C4=NC(=CO4)C5=NC(=CC=C5C6=NC(=CS6)C(=O)NC(C(C)O)C(=O)N1)C(=O)NC(=C)C(=O)NC(=C)C(=O)N)C(C)(C)O
InChI: InChI=1S/C50H49N15O15S/c1-12-27-48-61-30(16-79-48)41(72)54-21(5)39(70)65-35(50(10,11)77)45(76)57-23(7)47-64-33(25(9)80-47)44(75)55-20(4)38(69)56-22(6)46-60-29(15-78-46)34-26(49-62-31(17-81-49)42(73)63-32(24(8)66)43(74)59-27)13-14-28(58-34)40(71)53-19(3)37(68)52-18(2)36(51)67/h12-17,24,32,35,66,77H,2-7H2,1,8-11H3,(H2,51,67)(H,52,68)(H,53,71)(H,54,72)(H,55,75)(H,56,69)(H,57,76)(H,59,74)(H,63,73)(H,65,70)/b27-12+
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/16129809
Citation: https://www.nature.com/articles/s41429-018-0115-2

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