EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:181827 - [5,8a-bis(hydroxymethyl)-2,5-dimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol

ChEBI IDCHEBI:181827
ChEBI Name[5,8a-bis(hydroxymethyl)-2,5-dimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILESCC1=CCC2C(C)(CO)CCCC2(CO)C1CO
InChIInChI=1S/C15H26O3/c1-11-4-5-13-14(2,9-17)6-3-7-15(13,10-18)12(11)8-16/h4,12-13,16-18H,3,5-10H2,1-2H3
InChIKeyFUVVLIGUEPFKDK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
[5,8a-bis(hydroxymethyl)-2,5-dimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol (CHEBI:181827) is a primary alcohol (CHEBI:15734)
IUPAC Name 
[5,8a-bis(hydroxymethyl)-2,5-dimethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methanol