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CHEBI:220208 - Friulimicin A

ChEBI IDCHEBI:220208
ChEBI NameFriulimicin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC58H92N14O19
Net Charge0
Average Mass1289.453
Monoisotopic Mass1288.66632
SMILESCC(C)CCCCCC/C=C\CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1C(=O)N2CCCC[C@@H]2C(=O)N[C@@H]([C@H](C)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H]([C@@H](C)N)C(=O)N[C@H](C(C)C)C(=O)N2CCC[C@H]2C(=O)N[C@@H]1C
InChIInChI=1S/C58H92N14O19/c1-29(2)18-13-11-9-8-10-12-14-21-40(74)64-34(24-39(60)73)51(83)70-48-33(7)63-52(84)38-20-17-23-72(38)56(88)45(30(3)4)68-55(87)47(32(6)59)67-42(76)28-62-49(81)35(25-43(77)78)65-41(75)27-61-50(82)36(26-44(79)80)66-54(86)46(31(5)58(90)91)69-53(85)37-19-15-16-22-71(37)57(48)89/h12,14,29-38,45-48H,8-11,13,15-28,59H2,1-7H3,(H2,60,73)(H,61,82)(H,62,81)(H,63,84)(H,64,74)(H,65,75)(H,66,86)(H,67,76)(H,68,87)(H,69,85)(H,70,83)(H,77,78)(H,79,80)(H,90,91)/b14-12-/t31-,32+,33+,34-,35-,36-,37+,38-,45+,46-,47+,48-/m0/s1
InChIKeySLJYYRCUSIXQEQ-AJAGNRCHSA-N
Species of MetaboliteComponentSourceComments
Actinoplanes friuliensis DSM 7358 (ncbitaxon:1246995) - PubMed (11079804)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Friulimicin A (CHEBI:220208) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(2S)-2-[(3S,4R,7S,13R,16R,22S,28S,31S,34R)-16-[(1R)-1-aminoethyl]-3-[[(2S)-4-amino-2-[[(Z)-11-methyldodec-3-enoyl]amino]-4-oxobutanoyl]amino]-22,28-bis(carboxymethyl)-4-methyl-2,6,12,15,18,21,24,27,30,33-decaoxo-13-propan-2-yl-1,5,11,14,17,20,23,26,29,32-decazatricyclo[32.4.0.07,11]octatriacontan-31-yl]propanoic acid
Manual XrefsDatabases
78438730ChemSpider