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CHEBI:198782 - Leustroducsin A

ChEBI IDCHEBI:198782
ChEBI NameLeustroducsin A
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FormulaC32H52NO10P
Net Charge0
Average Mass641.739
Monoisotopic Mass641.33288
SMILESCC[C@H]1C=CC(=O)O[C@H]1/C=C/C(O)(CCN)[C@@H](C[C@@H](O)/C=C\C=C/[C@@H]1CCC[C@H](OC(=O)CCCC(C)C)C1)OP(=O)(O)O
InChIInChI=1S/C32H52NO10P/c1-4-25-15-16-31(36)42-28(25)17-18-32(37,19-20-33)29(43-44(38,39)40)22-26(34)12-6-5-10-24-11-8-13-27(21-24)41-30(35)14-7-9-23(2)3/h5-6,10,12,15-18,23-29,34,37H,4,7-9,11,13-14,19-22,33H2,1-3H3,(H2,38,39,40)/b10-5-,12-6-,18-17+/t24-,25+,26+,27+,28+,29-,32?/m1/s1
InChIKeySNWWAFHAEURECF-JDSSUHPRSA-N
ChEBI Ontology
Outgoing Relation(s)
Leustroducsin A (CHEBI:198782) is a pyranone (CHEBI:37963)
IUPAC Name 
[(1S,3R)-3-[(1Z,3Z,5R,7R,9E)-8-(2-aminoethyl)-10-[(2S,3S)-3-ethyl-6-oxo-2,3-dihydropyran-2-yl]-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl]cyclohexyl] 5-methylhexanoate
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