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CHEBI:218595 - Pestalpolyol D

ChEBI IDCHEBI:218595
ChEBI NamePestalpolyol D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H60O5
Net Charge0
Average Mass548.849
Monoisotopic Mass548.44408
SMILESCCC(=O)C(C)=C[C@H](C)[C@H](O)C(C)=C[C@H](C)[C@H](O)C(C)=C[C@H](C)[C@H](O)C(C)=C[C@@H](C)[C@H](O)[C@@H](C)C[C@@H](C)CC
InChIInChI=1S/C34H60O5/c1-13-20(3)15-22(5)31(36)24(7)17-26(9)33(38)28(11)19-29(12)34(39)27(10)18-25(8)32(37)23(6)16-21(4)30(35)14-2/h16-20,22-24,27-28,31-34,36-39H,13-15H2,1-12H3/t20-,22-,23-,24+,27-,28-,31+,32-,33+,34-/m0/s1
InChIKeyQDUZZGYQNVQPPB-NIBRYMIHSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsisspecies CR013 (ncbitaxon:1587512) - PubMed (26227504)
ChEBI Ontology
Outgoing Relation(s)
Pestalpolyol D (CHEBI:218595) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(6S,7S,10S,11S,14S,15S,18R,19R,20S,22S)-7,11,15,19-tetrahydroxy-4,6,8,10,12,14,16,18,20,22-decamethyltetracosa-4,8,12,16-tetraen-3-one
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