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CHEBI:214562 - Reveromycin K

ChEBI IDCHEBI:214562
ChEBI NameReveromycin K
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H50O12
Net Charge0
Average Mass698.806
Monoisotopic Mass698.33023
SMILESCCCC[C@@]1(OC(=O)c2coc(C(=O)O)c2)CC[C@]2(CC[C@H](C)[C@@H](C/C=C(C)/C=C/[C@H](O)[C@@H](C)/C=C/C(=O)O)O2)O[C@H]1/C=C/C(C)=C/C(=O)O
InChIInChI=1S/C38H50O12/c1-6-7-17-37(50-36(46)28-22-31(35(44)45)47-23-28)19-20-38(49-32(37)14-10-25(3)21-34(42)43)18-16-27(5)30(48-38)13-9-24(2)8-12-29(39)26(4)11-15-33(40)41/h8-12,14-15,21-23,26-27,29-30,32,39H,6-7,13,16-20H2,1-5H3,(H,40,41)(H,42,43)(H,44,45)/b12-8+,14-10+,15-11+,24-9+,25-21+/t26-,27-,29-,30+,32-,37+,38-/m0/s1
InChIKeyZBIIEXHGHPBXDS-ICLBWEOJSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (21152660)
ChEBI Ontology
Outgoing Relation(s)
Reveromycin K (CHEBI:214562) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
4-[[(2S,3R,6S,8R,9S)-3-butyl-8-[(2E,4E,6S,7S,8E)-9-carboxy-6-hydroxy-3,7-dimethylnona-2,4,8-trienyl]-2-[(1E,3E)-4-carboxy-3-methylbuta-1,3-dienyl]-9-methyl-1,7-dioxaspiro[5.5]undecan-3-yl]oxycarbonyl]uran-2-carboxylic acid
Manual XrefsDatabases
78439730ChemSpider