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CHEBI:210531 - Spliceostatin D

ChEBI IDCHEBI:210531
ChEBI NameSpliceostatin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H41NO8
Net Charge0
Average Mass519.635
Monoisotopic Mass519.28322
SMILESC=C1C[C@@H](CC(=O)O)O[C@H](/C=C/C(C)=C/C[C@@H]2O[C@H](C)[C@H](NC(=O)/C=C\[C@H](C)OC(C)=O)C[C@@H]2C)[C@H]1O
InChIInChI=1S/C28H41NO8/c1-16(8-11-25-28(34)18(3)13-22(37-25)15-27(32)33)7-10-24-17(2)14-23(20(5)36-24)29-26(31)12-9-19(4)35-21(6)30/h7-9,11-12,17,19-20,22-25,28,34H,3,10,13-15H2,1-2,4-6H3,(H,29,31)(H,32,33)/b11-8+,12-9-,16-7+/t17-,19-,20+,22-,23+,24-,25+,28-/m0/s1
InChIKeyPLEGVOTUAFLKRN-ISBBSCLOSA-N
Species of MetaboliteComponentSourceComments
Burkholderiaspecies FERM BP-3421 (ncbitaxon:1494466) - PubMed (25098528)
ChEBI Ontology
Outgoing Relation(s)
Spliceostatin D (CHEBI:210531) is a C-glycosyl compound (CHEBI:20857)
IUPAC Name 
2-[(2S,5S,6R)-6-[(1E,3E)-5-[(2S,3S,5R,6R)-5-[[(Z,4S)-4-acetyloxypent-2-enoyl]amino]-3,6-dimethyloxan-2-yl]-3-methylpenta-1,3-dienyl]-5-hydroxy-4-methylideneoxan-2-yl]acetic acid
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