EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:42345 - (1R,2S,3S,4R)-5-METHYLENECYCLOHEXANE-1,2,3,4-TETRAOL

Default Structure
ChEBI IDCHEBI:42345
ChEBI Name(1R,2S,3S,4R)-5-METHYLENECYCLOHEXANE-1,2,3,4-TETRAOL
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC7H12O4
Net Charge0
Average Mass160.169
Monoisotopic Mass160.07356
SMILES[H]O[C@]1([H])[C@@]([H])(O[H])[C@]([H])(O[H])C([H])([H])C(=C([H])[H])[C@@]1([H])O[H]
InChIInChI=1S/C7H12O4/c1-3-2-4(8)6(10)7(11)5(3)9/h4-11H,1-2H2/t4-,5-,6+,7+/m1/s1
InChIKeyDRZDCPGIBPDBFY-JWXFUTCRSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,2S,3S,4R)-5-METHYLENECYCLOHEXANE-1,2,3,4-TETRAOL (CHEBI:42345) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(1R,2S,3S,4R)-5-METHYLENECYCLOHEXANE-1,2,3,4-TETRAOLPDBeChem
(1R,2S,3S,4R)-5-methylidenecyclohexane-1,2,3,4-tetrolPDBeChem
Manual XrefsDatabases
EXOPDBeChem