EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:209045 - Microporenic acid G

ChEBI IDCHEBI:209045
ChEBI NameMicroporenic acid G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H42O9
Net Charge0
Average Mass498.613
Monoisotopic Mass498.28288
SMILESC/C(=C\CC/C(C)=C/CO[C@@H](C(=O)O)[C@H](CC(=O)O)C(=O)O)CC/C=C(\C)CC[C@H](O)C(C)(C)O
InChIInChI=1S/C26H42O9/c1-17(8-6-10-18(2)12-13-21(27)26(4,5)34)9-7-11-19(3)14-15-35-23(25(32)33)20(24(30)31)16-22(28)29/h9-10,14,20-21,23,27,34H,6-8,11-13,15-16H2,1-5H3,(H,28,29)(H,30,31)(H,32,33)/b17-9+,18-10+,19-14+/t20-,21-,23+/m0/s1
InChIKeyDPCUSWYDKNTEFG-LCSNTCRPSA-N
Species of MetaboliteComponentSourceComments
Microporusspecies (in: basidiomycete fungi) (ncbitaxon:2007320) - PubMed (29489350)
ChEBI Ontology
Outgoing Relation(s)
Microporenic acid G (CHEBI:209045) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1R,2S)-1-[(2E,6E,10E,14S)-14,15-dihydroxy-3,7,11,15-tetramethylhexadeca-2,6,10-trienoxy]propane-1,2,3-tricarboxylic acid
Manual XrefsDatabases
78439050ChemSpider