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CHEBI:222251 - Rotihibin D

ChEBI IDCHEBI:222251
ChEBI NameRotihibin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H67N11O13
Net Charge0
Average Mass874.007
Monoisotopic Mass873.49198
SMILESCCCCCCCC/C=C\C(=O)NC(CCCNC(N)=O)C(=O)NC(C(=O)NC(CCNC(=O)C(N)C(C)O)C(=O)NC(C(=O)NC(CO)CC(N)=O)C(O)C(N)=O)C(C)O
InChIInChI=1S/C37H67N11O13/c1-4-5-6-7-8-9-10-11-14-26(53)45-23(13-12-16-43-37(41)61)32(56)47-28(21(3)51)35(59)46-24(15-17-42-34(58)27(39)20(2)50)33(57)48-29(30(54)31(40)55)36(60)44-22(19-49)18-25(38)52/h11,14,20-24,27-30,49-51,54H,4-10,12-13,15-19,39H2,1-3H3,(H2,38,52)(H2,40,55)(H,42,58)(H,44,60)(H,45,53)(H,46,59)(H,47,56)(H,48,57)(H3,41,43,61)/b14-11-
InChIKeyBFBLDNMDKMTNIC-KAMYIIQDSA-N
Species of MetaboliteComponentSourceComments
Streptomyces scabiei (ncbitaxon:1930) - PubMed (34346752)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Rotihibin D (CHEBI:222251) is a polypeptide (CHEBI:15841)