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CHEBI:217040 - Botryotin G

ChEBI IDCHEBI:217040
ChEBI NameBotryotin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O5
Net Charge0
Average Mass352.471
Monoisotopic Mass352.22497
SMILESCC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1C(=O)C[C@@]1(O)C[C@](C)(O)[C@H]3CC[C@]12[C@@H]3O
InChIInChI=1S/C20H32O5/c1-16(2)13(22)6-7-17(3)14(16)12(21)9-19(25)10-18(4,24)11-5-8-20(17,19)15(11)23/h11,13-15,22-25H,5-10H2,1-4H3/t11-,13-,14-,15+,17-,18-,19+,20+/m0/s1
InChIKeyRVZZHJMPLQFGBO-WWMCQUNOSA-N
Species of MetaboliteComponentSourceComments
Botrytis cinerea (ncbitaxon:40559) - PubMed (31880464)
ChEBI Ontology
Outgoing Relation(s)
Botryotin G (CHEBI:217040) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1S,2S,5S,7R,10S,12S,13S,16R)-5,10,12,16-tetrahydroxy-2,6,6,12-tetramethyltetracyclo[11.2.1.01,10.02,7]hexadecan-8-one
Manual XrefsDatabases
81363753ChemSpider