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CHEBI:221696 - Virginiae butanolide D

ChEBI IDCHEBI:221696
ChEBI NameVirginiae butanolide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22O4
Net Charge0
Average Mass230.304
Monoisotopic Mass230.15181
SMILESCCCCCC[C@H](O)[C@@H]1C(=O)OC[C@H]1CO
InChIInChI=1S/C12H22O4/c1-2-3-4-5-6-10(14)11-9(7-13)8-16-12(11)15/h9-11,13-14H,2-8H2,1H3/t9-,10+,11-/m1/s1
InChIKeyJWZVDINGVWOBKH-OUAUKWLOSA-N
Species of MetaboliteComponentSourceComments
Streptomyces virginiae (ncbitaxon:1961) - PubMed (2621168)
ChEBI Ontology
Outgoing Relation(s)
Virginiae butanolide D (CHEBI:221696) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(3R,4R)-3-[(1S)-1-hydroxyheptyl]-4-(hydroxymethyl)oxolan-2-one
Manual XrefsDatabases
10340536ChemSpider