CHEBI:80889 - Picrasin A

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ChEBI Name Picrasin A
ChEBI ID CHEBI:80889
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H34O8
Net Charge 0
Average Mass 474.54340
Monoisotopic Mass 474.22537
InChI InChI=1S/C26H34O8/c1-12-6-16(32-5)23(31)25(3)14(12)8-18-26(4)17(9-20(29)34-18)24(2,10-15(27)21(25)26)22(30)13-7-19(28)33-11-13/h6,12-15,17-18,21,27H,7-11H2,1-5H3/t12-,13-,14+,15-,17+,18-,21-,24-,25+,26-/m1/s1
InChIKey BIJFTRIMTHYJOV-QRWZCSJESA-N
SMILES COC1=C[C@@H](C)[C@@H]2C[C@H]3OC(=O)C[C@H]4[C@@](C)(C[C@@H](O)[C@@H]([C@@]34C)[C@@]2(C)C1=O)C(=O)[C@H]1COC(=O)C1
ChEBI Ontology
Outgoing Picrasin A (CHEBI:80889) is a triterpenoid (CHEBI:36615)
Synonym Source
Nigakilactone G KEGG COMPOUND
Manual Xref Database
C17049 KEGG COMPOUND
View more database links
Registry Number Type Source
27368-79-2 CAS Registry Number KEGG COMPOUND