CHEBI:217879 - 3beta-acetoxy-24-methylene-8-en-26-oic este

ChEBI IDCHEBI:217879
ChEBI Name3beta-acetoxy-24-methylene-8-en-26-oic este
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H54O4
Net Charge0
Average Mass526.802
Monoisotopic Mass526.40221
SMILESC=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1CC3)C(C)C(=O)OC
InChIInChI=1S/C34H54O4/c1-21(23(3)30(36)37-10)11-12-22(2)25-15-19-34(9)27-13-14-28-31(5,6)29(38-24(4)35)17-18-32(28,7)26(27)16-20-33(25,34)8/h22-23,25,28-29H,1,11-20H2,2-10H3/t22-,23?,25-,28+,29+,32-,33-,34+/m1/s1
InChIKeyIRNLLINYJJZACX-QBOMDKGESA-N
Species of MetaboliteComponentSourceComments
Rhodofomes cajanderi (ncbitaxon:2066993) - PubMed (16835094)
ChEBI Ontology
Outgoing Relation(s)
3beta-acetoxy-24-methylene-8-en-26-oic este (CHEBI:217879) is a triterpenoid (CHEBI:36615)
IUPAC Name 
methyl (6R)-6-[(3S,5R,10S,13R,14R,17R)-3-acetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-3-methylideneheptanoate
Manual XrefsDatabases
78437589ChemSpider