CHEBI:80893 - Picrasin F

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ChEBI Name Picrasin F
ChEBI ID CHEBI:80893
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H30O8
Net Charge 0
Average Mass 422.46880
Monoisotopic Mass 422.19407
InChI InChI=1S/C22H30O8/c1-10-6-12(27-5)17(24)19(2)11(10)7-13-20(3)16(19)15-18(29-9-28-15)21(4,25)22(20,26)8-14(23)30-13/h6,10-11,13,15-16,18,25-26H,7-9H2,1-5H3/t10-,11+,13-,15+,16-,18-,19+,20-,21-,22+/m1/s1
InChIKey PTNGNIZYEVURDF-FCESQLEQSA-N
SMILES COC1=C[C@@H](C)[C@@H]2C[C@H]3OC(=O)C[C@@]4(O)[C@](C)(O)[C@@H]5OCO[C@H]5[C@H]([C@@]2(C)C1=O)[C@@]34C
ChEBI Ontology
Outgoing Picrasin F (CHEBI:80893) is a triterpenoid (CHEBI:36615)
Manual Xref Database
C17053 KEGG COMPOUND
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