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CHEBI:221128 - Polyoxin F

ChEBI IDCHEBI:221128
ChEBI NamePolyoxin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H30N6O15
Net Charge0
Average Mass630.520
Monoisotopic Mass630.17691
SMILESCC=C1CN(C(=O)[C@@H](NC(=O)[C@@H](N)[C@H](O)[C@@H](O)COC(N)=O)[C@H]2O[C@@H](n3cc(C(=O)O)c(=O)nc3=O)[C@H](O)[C@@H]2O)[C@@H]1C(=O)O
InChIInChI=1S/C23H30N6O15/c1-2-6-3-28(11(6)21(39)40)18(36)10(26-17(35)9(24)12(31)8(30)5-43-22(25)41)15-13(32)14(33)19(44-15)29-4-7(20(37)38)16(34)27-23(29)42/h2,4,8-15,19,30-33H,3,5,24H2,1H3,(H2,25,41)(H,26,35)(H,37,38)(H,39,40)(H,27,34,42)/t8-,9-,10-,11-,12+,13-,14+,15+,19+/m0/s1
InChIKeyYOTRXRRLNVGLSU-HDZPVWRQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (5358618)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Polyoxin F (CHEBI:221128) is a peptide (CHEBI:16670)
IUPAC Name 
1-[(2R,3R,4S,5R)-5-[(1S)-1-[[(2S,3S,4S)-2-amino-5-carbamoyloxy-3,4-dihydroxypentanoyl]amino]-2-[(2S)-2-carboxy-3-ethylideneazetidin-1-yl]-2-oxoethyl]-3,4-dihydroxyoxolan-2-yl]-2,4-dioxopyrimidine-5-carboxylic acid