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CHEBI:213309 - Chrondramide 13C

ChEBI IDCHEBI:213309
ChEBI NameChrondramide 13C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H43BrN4O6
Net Charge0
Average Mass695.655
Monoisotopic Mass694.23660
SMILESC/C1=C/[C@H](C)[C@@H](C)OC(=O)CC(c2ccc(O)c(Br)c2)NC(=O)[C@@H](Cc2cnc3ccccc23)N(C)C(=O)[C@H](C)NC(=O)[C@@H](C)C1
InChIInChI=1S/C35H43BrN4O6/c1-19-13-20(2)23(5)46-32(42)17-29(24-11-12-31(41)27(36)15-24)39-34(44)30(16-25-18-37-28-10-8-7-9-26(25)28)40(6)35(45)22(4)38-33(43)21(3)14-19/h7-13,15,18,20-23,29-30,37,41H,14,16-17H2,1-6H3,(H,38,43)(H,39,44)/b19-13-/t20-,21-,22-,23+,29?,30+/m0/s1
InChIKeyUPRQPHQCCRDMTD-JRXUSEEXSA-N
Species of MetaboliteComponentSourceComments
Chondromyces (ncbitaxon:50) - PubMed (23959765)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Chrondramide 13C (CHEBI:213309) is a peptide (CHEBI:16670)
IUPAC Name 
(7R,10S,13S,15Z,17S,18R)-4-(3-bromo-4-hydroxyphenyl)-7-(1H-indol-3-ylmethyl)-8,10,13,15,17,18-hexamethyl-1-oxa-5,8,11-triazacyclooctadec-15-ene-2,6,9,12-tetrone
Manual XrefsDatabases
78442774ChemSpider