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CHEBI:217714 - Reveromycin G

ChEBI IDCHEBI:217714
ChEBI NameReveromycin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H56O11
Net Charge0
Average Mass688.855
Monoisotopic Mass688.38226
SMILESCCCCCC[C@]1([C@H](/C=C/C(C)=C/C(=O)O)OC(=O)CCC(=O)O)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)O1
InChIInChI=1S/C38H56O11/c1-6-7-8-9-21-37(32(16-12-27(3)25-35(44)45)47-36(46)19-18-34(42)43)23-24-38(49-37)22-20-29(5)31(48-38)15-11-26(2)10-14-30(39)28(4)13-17-33(40)41/h10-14,16-17,25,28-32,39H,6-9,15,18-24H2,1-5H3,(H,40,41)(H,42,43)(H,44,45)/b14-10+,16-12+,17-13+,26-11+,27-25+/t28-,29-,30-,31+,32-,37+,38-/m0/s1
InChIKeyXMGURGIMJAMEES-NMEWUHLLSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies SN-593 (ncbitaxon:659352) - PubMed (21152660)
ChEBI Ontology
Outgoing Relation(s)
Reveromycin G (CHEBI:217714) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
(2E,4S,5S,6E,8E)-10-[(2R,5S,8S,9R)-2-[(1S,2E,4E)-5-carboxy-1-(3-carboxypropanoyloxy)-4-methylpenta-2,4-dienyl]-2-hexyl-8-methyl-1,10-dioxaspiro[4.5]decan-9-yl]-5-hydroxy-4,8-dimethyldeca-2,6,8-trienoic acid
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78439861ChemSpider