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CHEBI:220058 - Tetronomycin

ChEBI IDCHEBI:220058
ChEBI NameTetronomycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H50O8
Net Charge0
Average Mass586.766
Monoisotopic Mass586.35057
SMILESC=C1OC(=O)C(C(=O)[C@H](C)[C@H]2[C@H](/C=C(\CO)[C@H]3O[C@@H](/C=C/C[C@@H]4CC[C@@H]([C@@H](C)OC)O4)CC[C@@H]3C)CCC[C@@H]2C)=C1O
InChIInChI=1S/C34H50O8/c1-19-9-7-10-24(29(19)21(3)31(36)30-32(37)23(5)40-34(30)38)17-25(18-35)33-20(2)13-14-27(42-33)12-8-11-26-15-16-28(41-26)22(4)39-6/h8,12,17,19-22,24,26-29,33,35,37H,5,7,9-11,13-16,18H2,1-4,6H3/b12-8+,25-17+/t19-,20-,21+,22+,24-,26+,27-,28-,29-,33-/m0/s1
InChIKeyRDKPMGJEUBFWAE-OUIQBBCVSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7076564)
ChEBI Ontology
Outgoing Relation(s)
Tetronomycin (CHEBI:220058) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
4-hydroxy-3-[(2R)-2-[(1R,2R,6S)-2-[(E)-3-hydroxy-2-[(2S,3S,6R)-6-[(E)-3-[(2S,5S)-5-[(1R)-1-methoxyethyl]oxolan-2-yl]prop-1-enyl]-3-methyloxan-2-yl]prop-1-enyl]-6-methylcyclohexyl]propanoyl]-5-methylideneuran-2-one
Manual XrefsDatabases
74048336ChemSpider