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CHEBI:202118 - D-Ornithinegalantin I

Default Structure
ChEBI IDCHEBI:202118
ChEBI NameD-Ornithinegalantin I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H84N14O13
Net Charge0
Average Mass981.208
Monoisotopic Mass980.63423
SMILESCNCC(NC(=O)CC(O)CC(O)C(CO)NC(=O)C(CCCN)NC(=O)C(CN)NC(=O)C(C)NC(=O)C(O)C(O)CC(O)C(N)CCCCN)C(=O)NCC(=O)NCCCCNCCCN
InChIInChI=1S/C41H84N14O13/c1-24(51-41(68)36(63)33(60)19-31(58)26(46)9-3-4-11-42)37(64)54-28(20-45)40(67)53-27(10-7-12-43)39(66)55-30(23-56)32(59)17-25(57)18-34(61)52-29(21-47-2)38(65)50-22-35(62)49-16-6-5-14-48-15-8-13-44/h24-33,36,47-48,56-60,63H,3-23,42-46H2,1-2H3,(H,49,62)(H,50,65)(H,51,68)(H,52,61)(H,53,67)(H,54,64)(H,55,66)
InChIKeyBYECHTCUXAQVHW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bacillusspecies (in: firmicutes) (ncbitaxon:1409) - PubMed (1112763)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
D-Ornithinegalantin I (CHEBI:202118) is a oligopeptide (CHEBI:25676)
IUPAC Name 
6,10-diamino-N-[1-[[3-amino-1-[[5-amino-1-[[7-[[1-[[2-[4-(3-aminopropylamino)butylamino]-2-oxoethyl]amino]-3-(methylamino)-1-oxopropan-2-yl]amino]-1,3,5-trihydroxy-7-oxoheptan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]-2,3,5-trihydroxydecanamide
Manual XrefsDatabases
78444001ChemSpider