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CHEBI:221143 - Polyoxin I

ChEBI IDCHEBI:221143
ChEBI NamePolyoxin I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H22N4O9
Net Charge0
Average Mass426.382
Monoisotopic Mass426.13868
SMILESC/C=C1\CN(C(=O)[C@@H](N)[C@H]2O[C@@H](n3cc(CO)c(=O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1C(=O)O
InChIInChI=1S/C17H22N4O9/c1-2-6-3-20(9(6)16(27)28)14(26)8(18)12-10(23)11(24)15(30-12)21-4-7(5-22)13(25)19-17(21)29/h2,4,8-12,15,22-24H,3,5,18H2,1H3,(H,27,28)(H,19,25,29)/b6-2+/t8-,9-,10-,11+,12+,15+/m0/s1
InChIKeyPYKBUMNCUPHKDK-UJTCPRONSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (5358618)
ChEBI Ontology
Outgoing Relation(s)
Polyoxin I (CHEBI:221143) is a 5'-deoxyribonucleoside (CHEBI:36988)
IUPAC Name 
(2S,3E)-1-[(2S)-2-amino-2-[(2R,3S,4R,5R)-3,4-dihydroxy-5-[5-(hydroxymethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]acetyl]-3-ethylideneazetidine-2-carboxylic acid