EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:227615 - Pargamicin A

ChEBI IDCHEBI:227615
ChEBI NamePargamicin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H52N8O9
Net Charge0
Average Mass716.837
Monoisotopic Mass716.38573
SMILESCCC(C)C1C(=O)N2NCCCC2C(=O)N(C)C(C(C)(C)O)C(=O)N2NCC(O)CC2C(=O)N(C)CC(=O)NC(Cc2ccccc2)C(=O)N1O
InChIInChI=1S/C34H52N8O9/c1-7-20(2)27-32(48)40-24(14-11-15-35-40)31(47)39(6)28(34(3,4)50)33(49)41-25(17-22(43)18-36-41)30(46)38(5)19-26(44)37-23(29(45)42(27)51)16-21-12-9-8-10-13-21/h8-10,12-13,20,22-25,27-28,35-36,43,50-51H,7,11,14-19H2,1-6H3,(H,37,44)
InChIKeyRKUJJLKDDIAXRJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Amycolatopsisspecies (ncbitaxon:37632) - PubMed (18667787)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Pargamicin A (CHEBI:227615) is a oligopeptide (CHEBI:25676)
IUPAC Name 
16-benzyl-13-butan-2-yl-14,24-dihydroxy-3-(2-hydroxypropan-2-yl)-4,20-dimethyl-1,4,10,11,14,17,20,26-octazatricyclo[20.4.0.06,11]hexacosane-2,5,12,15,18,21-hexone
Manual XrefsDatabases
28285464ChemSpider