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CHEBI:224015 - Lasalocid E

ChEBI IDCHEBI:224015
ChEBI NameLasalocid E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC35H56O8
Net Charge0
Average Mass604.825
Monoisotopic Mass604.39752
SMILESCC[C@H]1C[C@@](CC)([C@H]2CC[C@](O)(CC)[C@H](C)O2)O[C@@H]1[C@@H](CC)C(=O)[C@@H](C)[C@@H](O)[C@H](C)CCc1ccc(C)c(O)c1C(=O)O
InChIInChI=1S/C35H56O8/c1-9-24-19-35(12-4,27-17-18-34(41,11-3)23(8)42-27)43-32(24)26(10-2)31(38)22(7)29(36)20(5)13-15-25-16-14-21(6)30(37)28(25)33(39)40/h14,16,20,22-24,26-27,29,32,36-37,41H,9-13,15,17-19H2,1-8H3,(H,39,40)/t20-,22+,23+,24+,26+,27-,29+,32+,34-,35+/m1/s1
InChIKeyRXCDHVAYLRJHOW-JXAGNTGFSA-N
Species of MetaboliteComponentSourceComments
Streptomyces lasalocidi (ncbitaxon:324833) - PubMed (4457525)
ChEBI Ontology
Outgoing Relation(s)
Lasalocid E (CHEBI:224015) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
6-[(3R,4S,5S,7R)-7-[(2S,3S,5S)-3,5-diethyl-5-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyloxan-2-yl]oxolan-2-yl]-4-hydroxy-3,5-dimethyl-6-oxononyl]-2-hydroxy-3-methylbenzoic acid
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8614040ChemSpider