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CHEBI:223903 - Guadinomine C1

ChEBI IDCHEBI:223903
ChEBI NameGuadinomine C1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H40N8O8
Net Charge0
Average Mass556.621
Monoisotopic Mass556.29691
SMILESCC1NC(C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)C(CCC(O)C(O)CC2CN(C(N)=O)C(N)=N2)NC1=O
InChIInChI=1S/C23H40N8O8/c1-9(2)16(21(37)38)30-19(35)11(4)27-20(36)17-13(29-18(34)10(3)26-17)5-6-14(32)15(33)7-12-8-31(23(25)39)22(24)28-12/h9-17,26,32-33H,5-8H2,1-4H3,(H2,24,28)(H2,25,39)(H,27,36)(H,29,34)(H,30,35)(H,37,38)/t10?,11-,12?,13?,14?,15?,16-,17?/m0/s1
InChIKeyYULBZOGRTPPGQN-BMCSNDFDSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies K01-0509 (ncbitaxon:1238679) - PubMed (18503202)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Guadinomine C1 (CHEBI:223903) is a oligopeptide (CHEBI:25676)
IUPAC Name 
(2S)-2-[[(2S)-2-[[3-[5-(2-amino-1-carbamoyl-4,5-dihydroimidazol-4-yl)-3,4-dihydroxypentyl]-6-methyl-5-oxopiperazine-2-carbonyl]amino]propanoyl]amino]-3-methylbutanoic acid
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