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CHEBI:225221 - Laetiposide G

Default Structure
ChEBI IDCHEBI:225221
ChEBI NameLaetiposide G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H60O9
Net Charge0
Average Mass648.878
Monoisotopic Mass648.42373
SMILESC=C(CC[C@@H](C(=O)OC1OC(CO)C(O)C(O)C1O)[C@H]1C[C@H](O)[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3)C(C)C
InChIInChI=1S/C37H60O9/c1-19(2)20(3)9-10-21(32(44)46-33-31(43)30(42)29(41)25(18-38)45-33)24-17-28(40)37(8)23-11-12-26-34(4,5)27(39)14-15-35(26,6)22(23)13-16-36(24,37)7/h19,21,24-31,33,38-43H,3,9-18H2,1-2,4-8H3/t21-,24-,25?,26?,27+,28+,29?,30?,31?,33?,35-,36-,37-/m1/s1
InChIKeyWZXIJXGYBNLZLW-SOBNPRNHSA-N
Species of MetaboliteComponentSourceComments
Laetiporus versisporus (ncbitaxon:447507) - PubMed (11045442)
ChEBI Ontology
Outgoing Relation(s)
Laetiposide G (CHEBI:225221) is a triterpenoid (CHEBI:36615)
IUPAC Name 
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2R)-2-[(3S,10S,13R,14R,15S,17R)-3,15-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoate
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78443759ChemSpider