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CHEBI:137227 - Porrigenin A

Default Structure
ChEBI IDCHEBI:137227
ChEBI NamePorrigenin A
Stars
Last Modified31 May 2017
Submittermwilliams
DownloadsMolfile
FormulaC27H44O5
Net Charge0
Average Mass448.644
Monoisotopic Mass448.31887
SMILES[H][C@@]12C[C@@H](O)[C@@]3([H])C[C@@H](O)[C@@H](O)C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H]3[C@H](C[C@@]21[H])O[C@]1(CC[C@@H](C)CO1)[C@H]3C
InChIInChI=1S/C27H44O5/c1-14-5-8-27(31-13-14)15(2)24-23(32-27)11-18-16-9-20(28)19-10-21(29)22(30)12-26(19,4)17(16)6-7-25(18,24)3/h14-24,28-30H,5-13H2,1-4H3/t14-,15+,16-,17+,18+,19-,20-,21-,22+,23+,24+,25+,26-,27-/m1/s1
InChIKeyFYRLHXNMINIDCB-FJQPKSSRSA-N
ChEBI Ontology
Outgoing Relation(s)
Porrigenin A (CHEBI:137227) is a triterpenoid (CHEBI:36615)
Synonym  Source
(25R)-5α-spirostan-2β,3β,6β-triolLIPID MAPS
Manual XrefsDatabases
LMST01080001LIPID MAPS