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CHEBI:211626 - X-14889A

ChEBI IDCHEBI:211626
ChEBI NameX-14889A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H60O8
Net Charge0
Average Mass584.835
Monoisotopic Mass584.42882
SMILESCC[C@@H](C(=O)[C@@H](C)[C@@H](O)[C@H](C)[C@H]1O[C@@](O)(CC)[C@H](C)C[C@@H]1C)[C@H]1O[C@](C)([C@]2(O)O[C@@](CC)([C@@H](C)O)C[C@H]2C)C[C@@H]1C
InChIInChI=1S/C33H60O8/c1-12-25(27(36)22(8)26(35)23(9)28-18(4)15-20(6)32(37,14-3)40-28)29-19(5)16-30(11,39-29)33(38)21(7)17-31(13-2,41-33)24(10)34/h18-26,28-29,34-35,37-38H,12-17H2,1-11H3/t18-,19-,20+,21+,22-,23-,24+,25-,26+,28-,29-,30-,31+,32-,33+/m0/s1
InChIKeyCQTXDSXQPBLXND-BCHYDHNPSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (8468243)
ChEBI Ontology
Outgoing Relation(s)
X-14889A (CHEBI:211626) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(3R,5S,6S,7S)-7-[(2S,3S,5R,6S)-6-ethyl-6-hydroxy-3,5-dimethyloxan-2-yl]-3-[(2S,3S,5S)-5-[(2R,3R,5R)-5-ethyl-2-hydroxy-5-[(1R)-1-hydroxyethyl]-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-6-hydroxy-5-methyloctan-4-one