3S-Methyloctan-4S-ol (CHEBI:178393)

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	3S-Methyloctan-4S-ol

ChEBI ID	CHEBI:178393

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C9H20O

Net Charge

Average Mass

144.258

Monoisotopic Mass

144.15142

InChI

InChI=1S/C9H20O/c1-4-6-7-9(10)8(3)5-2/h8-10H,4-7H2,1-3H3/t8-,9-/m0/s1

InChIKey

MJOKZMZDONULOD-IUCAKERBSA-N

SMILES

O[C@H]([C@H](CC)C)CCCC

ChEBI Ontology
Outgoing	3S-Methyloctan-4S-ol (CHEBI:178393) is a secondary alcohol (CHEBI:35681)

IUPAC Name

(3S,4S)-3-methyloctan-4-ol