Metabolites-BOC Sciences

A21459 A

A21459 A

Catalog number: BBF-03130

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Catalog Number BBF-03130
Description A21459 A is a cyclic peptide antibiotic produced by Actinoplanes sp. It has anti-clostridium (MIC 0.03-8 μg/mL) and mycoplasma (MIC 2 μg/mL) activity.
Molecular Formula C41H46N10O8S
Molecular Weight 838.93
Antibiotic Activity Spectrum mycoplasma
Synonyms A21459A
IUPAC Name 13-ethyl-4-(1H-indol-3-ylmethyl)-7-[(5-methoxy-1H-indol-3-yl)methyl]-18,22-dimethyl-16-methylidene-24-thia-3,6,9,12,15,18,21,26-octazabicyclo[21.2.1]hexacosa-1(25),23(26)-diene-2,5,8,11,14,17,20-heptone
Canonical SMILES CCC1C(=O)NC(=C)C(=O)N(CC(=O)NC(C2=NC(=CS2)C(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)CC3=CNC4=C3C=C(C=C4)OC)CC5=CNC6=CC=CC=C65)C)C
InChI InChI=1S/C41H46N10O8S/c1-6-28-37(55)46-22(3)41(58)51(4)19-35(53)45-21(2)40-50-33(20-60-40)39(57)49-32(13-23-16-42-29-10-8-7-9-26(23)29)38(56)48-31(36(54)44-18-34(52)47-28)14-24-17-43-30-12-11-25(59-5)15-27(24)30/h7-12,15-17,20-21,28,31-32,42-43H,3,6,13-14,18-19H2,1-2,4-5H3,(H,44,54)(H,45,53)(H,46,55)(H,47,52)(H,48,56)(H,49,57)
InChI Key PSBVOIWKVJOOJJ-UHFFFAOYSA-N
Boiling Point 1375.2±65.0°C at 760 mmHg
Density 1.4±0.1 g/cm3
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