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CHEBI:217539 - 10,23-dihydro-24,25-dehydroaflavinine

ChEBI IDCHEBI:217539
ChEBI Name10,23-dihydro-24,25-dehydroaflavinine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H39NO
Net Charge0
Average Mass405.626
Monoisotopic Mass405.30316
SMILESC=C(C)[C@@H]1CC[C@]23[C@H]([C@H]1c1cnc4ccccc14)[C@H](C)CC[C@@]2(C)[C@H](C)CC[C@@H]3O
InChIInChI=1S/C28H39NO/c1-17(2)20-13-15-28-24(30)11-10-19(4)27(28,5)14-12-18(3)26(28)25(20)22-16-29-23-9-7-6-8-21(22)23/h6-9,16,18-20,24-26,29-30H,1,10-15H2,2-5H3/t18-,19-,20+,24+,25-,26+,27+,28+/m1/s1
InChIKeyPCTLYBSZNQCIJC-KEQHSKTGSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/s0040-4020(01)81077-2)
ChEBI Ontology
Outgoing Relation(s)
10,23-dihydro-24,25-dehydroaflavinine (CHEBI:217539) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,4R,4aS,7R,7aS,8S,9R,11aS)-8-(1H-indol-3-yl)-4,4a,7-trimethyl-9-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,8,9,10,11-dodecahydrobenzo[i]naphthalen-1-ol
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10313763ChemSpider