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CHEBI:207787 - Aleurodiscal

ChEBI IDCHEBI:207787
ChEBI NameAleurodiscal
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H48O7
Net Charge0
Average Mass532.718
Monoisotopic Mass532.34000
SMILESC/C1=C2\C[C@H](OC3OCC(O)C(O)C3O)[C@@H](C)[C@@H]2C/C=C(/C=O)[C@@]2(C)C[C@@]3(C)C[C@@H](O)[C@@H](C(C)C)[C@@H]3C[C@H]12
InChIInChI=1S/C31H48O7/c1-15(2)26-22-10-21-16(3)20-9-25(38-29-28(36)27(35)24(34)13-37-29)17(4)19(20)8-7-18(12-32)31(21,6)14-30(22,5)11-23(26)33/h7,12,15,17,19,21-29,33-36H,8-11,13-14H2,1-6H3/b18-7-,20-16-/t17-,19-,21+,22-,23+,24?,25-,26-,27?,28?,29?,30+,31+/m0/s1
InChIKeyCDZNHIZHUOUKPS-WUFMIMRESA-N
Species of MetaboliteComponentSourceComments
Gloeosoma mirabile (ncbitaxon:166468) - PubMed (2500412)
ChEBI Ontology
Outgoing Relation(s)
Aleurodiscal (CHEBI:207787) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(1R,2Z,5S,6S,7S,9E,11S,13S,15R,16S,17S)-15-hydroxy-2,6,11,13-tetramethyl-16-propan-2-yl-5-(3,4,5-trihydroxyoxan-2-yl)oxytetracyclo[9.7.0.03,7.013,17]octadeca-2,9-diene-10-carbaldehyde
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78445161ChemSpider