EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:212750 - Nostamide B

ChEBI IDCHEBI:212750
ChEBI NameNostamide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H63N7O8
Net Charge0
Average Mass806.018
Monoisotopic Mass805.47381
SMILESCCC(C)C(NC(=O)NC1CCCCNC(=O)C(CCc2ccccc2)NC(=O)C(C)N(C)C(=O)C(CCc2ccccc2)NC(=O)C(C(C)CC)NC1=O)C(=O)O
InChIInChI=1S/C43H63N7O8/c1-7-27(3)35-40(54)46-34(25-23-31-19-13-10-14-20-31)41(55)50(6)29(5)37(51)45-33(24-22-30-17-11-9-12-18-30)38(52)44-26-16-15-21-32(39(53)48-35)47-43(58)49-36(42(56)57)28(4)8-2/h9-14,17-20,27-29,32-36H,7-8,15-16,21-26H2,1-6H3,(H,44,52)(H,45,51)(H,46,54)(H,48,53)(H,56,57)(H2,47,49,58)
InChIKeyWHFXVNGDVHVYFT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nostocspecies CENA543 (ncbitaxon:1869241) - PubMed (28933529)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Nostamide B (CHEBI:212750) is a cyclic peptide (CHEBI:23449)
IUPAC Name 
2-[[12-butan-2-yl-6,7-dimethyl-2,5,8,11,14-pentaoxo-3,9-bis(2-phenylethyl)-1,4,7,10,13-pentazacyclononadec-15-yl]carbamoylamino]-3-methylpentanoic acid