EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:200685 - Spirocardin B

ChEBI IDCHEBI:200685
ChEBI NameSpirocardin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O6
Net Charge0
Average Mass368.470
Monoisotopic Mass368.21989
SMILESCC1=CCCC2C1(C)C(=O)C(O)C(C)C2(C)CC(O)C1(C(O)CO)CO1
InChIInChI=1S/C20H32O6/c1-11-6-5-7-13-18(3,12(2)16(24)17(25)19(11,13)4)8-14(22)20(10-26-20)15(23)9-21/h6,12-16,21-24H,5,7-10H2,1-4H3
InChIKeyPDPQILPMCDOHDB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nocardia (ncbitaxon:1817) - PubMed (2621157)
ChEBI Ontology
Outgoing Relation(s)
Spirocardin B (CHEBI:200685) is a diterpenoid (CHEBI:23849)
IUPAC Name 
4-[2-[2-(1,2-dihydroxyethyl)oxiran-2-yl]-2-hydroxyethyl]-2-hydroxy-3,4,8,8a-tetramethyl-3,4a,5,6-tetrahydro-2H-naphthalen-1-one
Manual XrefsDatabases
112991ChemSpider