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CHEBI:212911 - Laetiposide F

Default Structure
ChEBI IDCHEBI:212911
ChEBI NameLaetiposide F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H60O10
Net Charge0
Average Mass664.877
Monoisotopic Mass664.41865
SMILESC=C(CC[C@@H](C(=O)O)[C@H]1C[C@H](O)[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1C[C@H]3OC1OC(CO)C(O)C(O)C1O)C(C)C
InChIInChI=1S/C37H60O10/c1-18(2)19(3)9-10-20(32(44)45)22-15-27(40)37(8)28-21(11-14-36(22,37)7)35(6)13-12-26(39)34(4,5)25(35)16-23(28)46-33-31(43)30(42)29(41)24(17-38)47-33/h18,20,22-27,29-31,33,38-43H,3,9-17H2,1-2,4-8H3,(H,44,45)/t20-,22-,23-,24?,25?,26+,27+,29?,30?,31?,33?,35-,36-,37+/m1/s1
InChIKeyNAOJYHWAAQJVSQ-CRJLGRKESA-N
Species of MetaboliteComponentSourceComments
Laetiporus versisporus (ncbitaxon:447507) - PubMed (11045442)
ChEBI Ontology
Outgoing Relation(s)
Laetiposide F (CHEBI:212911) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(2R)-2-[(3S,7R,10S,13R,14R,15S,17R)-3,15-dihydroxy-4,4,10,13,14-pentamethyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methyl-5-methylideneheptanoic acid
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78443742ChemSpider