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CHEBI:202395 - Fusarielin D

ChEBI IDCHEBI:202395
ChEBI NameFusarielin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H36O4
Net Charge0
Average Mass400.559
Monoisotopic Mass400.26136
SMILESC/C=C(\C)[C@H]1[C@@H](/C=C/C=C(\C)C(=O)C(C)CO)[C@@H]2C[C@@H]3O[C@]3(C)C[C@H]2[C@@H]2O[C@@]21C
InChIInChI=1S/C25H36O4/c1-7-14(2)21-17(10-8-9-15(3)22(27)16(4)13-26)18-11-20-24(5,28-20)12-19(18)23-25(21,6)29-23/h7-10,16-21,23,26H,11-13H2,1-6H3/b10-8+,14-7+,15-9+/t16?,17-,18-,19+,20-,21-,23-,24+,25+/m0/s1
InChIKeyTZLAKQNUAICCGL-DHQJTKRFSA-N
Species of MetaboliteComponentSourceComments
Fusariumspecies (ncbitaxon:29916) - PubMed (7868388)
ChEBI Ontology
Outgoing Relation(s)
Fusarielin D (CHEBI:202395) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(4E,6E)-7-[(1R,2S,4R,5R,6S,7S,9S,11R)-5-[(E)-but-2-en-2-yl]-4,11-dimethyl-3,10-dioxatetracyclo[5.5.0.02,4.09,11]dodecan-6-yl]-1-hydroxy-2,4-dimethylhepta-4,6-dien-3-one
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8606560ChemSpider