CHEBI:179510 - (4R,6S)-4-Hydroxy-1,7-dioxaspiro[5.5]undecane

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name (4R,6S)-4-Hydroxy-1,7-dioxaspiro[5.5]undecane
ChEBI ID CHEBI:179510
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H16O3
Net Charge 0
Average Mass 172.224
Monoisotopic Mass 172.10994
InChI InChI=1S/C9H16O3/c10-8-3-6-12-9(7-8)4-1-2-5-11-9/h8,10H,1-7H2/t8-,9+/m1/s1
InChIKey ITVCIGAVUFJFJY-BDAKNGLRSA-N
SMILES O1[C@]2(OCCCC2)C[C@H](O)CC1
ChEBI Ontology
Outgoing (4R,6S)-4-Hydroxy-1,7-dioxaspiro[5.5]undecane (CHEBI:179510) is a ketal (CHEBI:59777)
IUPAC Name
(4R,6S)-1,7-dioxaspiro[5.5]undecan-4-ol
Manual Xrefs Databases
61664811 ChemSpider
LMPK09000007 LIPID MAPS
View more database links