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CHEBI:212460 - Dichomitin B

ChEBI IDCHEBI:212460
ChEBI NameDichomitin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILESC[C@@H]1C[C@@H](O)[C@H]2[C@@H]1[C@H]1[C@@H](CC[C@@]2(C)O)[C@]1(C)CO
InChIInChI=1S/C15H26O3/c1-8-6-10(17)13-11(8)12-9(14(12,2)7-16)4-5-15(13,3)18/h8-13,16-18H,4-7H2,1-3H3/t8-,9-,10-,11+,12-,13+,14+,15-/m1/s1
InChIKeyDDVAVJSIHXELQF-WHNZPNJCSA-N
Species of MetaboliteComponentSourceComments
Dichomitus squalens (ncbitaxon:114155) - PubMed (15620268)
ChEBI Ontology
Outgoing Relation(s)
Dichomitin B (CHEBI:212460) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1S,1aR,4R,4aR,5R,7R,7aS,7bS)-1-(hydroxymethyl)-1,4,7-trimethyl-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene-4,5-diol
Manual XrefsDatabases
9463265ChemSpider