CHEBI:206508 - Coralmycin C

ChEBI IDCHEBI:206508
ChEBI NameCoralmycin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC46H44N6O15
Net Charge0
Average Mass920.885
Monoisotopic Mass920.28646
SMILESCO[C@@H](C(=O)O)[C@H](NC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1)C(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)Nc3ccc(C(=O)O)cc3OC(C)C)c(O)c2OC(C)C)cc1
InChIInChI=1S/C46H44N6O15/c1-23(2)66-35-22-28(45(59)60)12-20-33(35)49-43(57)32-19-21-34(38(37(32)53)67-24(3)4)50-41(55)25-6-15-30(16-7-25)48-44(58)36(39(65-5)46(61)62)51-42(56)26-8-13-29(14-9-26)47-40(54)27-10-17-31(18-11-27)52(63)64/h6-24,36,39,53H,1-5H3,(H,47,54)(H,48,58)(H,49,57)(H,50,55)(H,51,56)(H,59,60)(H,61,62)/t36-,39+/m0/s1
InChIKeyCOERGQLNLZNYLZ-YFXFWNCGSA-N
Species of MetaboliteComponentSourceComments
Corallococcus (ncbitaxon:83461) - PubMed (30970590)
ChEBI Ontology
Outgoing Relation(s)
Coralmycin C (CHEBI:206508) is a benzamides (CHEBI:22702)
IUPAC Name 
4-[[4-[[4-[[(2S,3R)-3-carboxy-3-methoxy-2-[[4-[(4-nitrobenzoyl)amino]benzoyl]amino]propanoyl]amino]benzoyl]amino]-2-hydroxy-3-propan-2-yloxybenzoyl]amino]-3-propan-2-yloxybenzoic acid