CHEBI:7919 - Papyriferic acid

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ChEBI Name Papyriferic acid
ChEBI ID CHEBI:7919
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C35H56O8
Net Charge 0
Average Mass 604.816
Monoisotopic Mass 604.39752
InChI InChI=1S/C35H56O8/c1-20(36)41-22-18-24-32(6)14-12-25(42-28(39)19-27(37)38)30(2,3)23(32)11-16-33(24,7)34(8)15-10-21(29(22)34)35(9)17-13-26(43-35)31(4,5)40/h21-26,29,40H,10-19H2,1-9H3,(H,37,38)/t21-,22+,23-,24+,25+,26+,29-,32-,33+,34+,35-/m0/s1
InChIKey RLVAVWQAAQFUOP-GNYBQDBLSA-N
SMILES CC(=O)O[C@@H]1C[C@@H]2[C@@]3(C)CC[C@@H](OC(=O)CC(O)=O)C(C)(C)[C@@H]3CC[C@@]2(C)[C@]2(C)CC[C@@H]([C@@H]12)[C@]1(C)CC[C@@H](O1)C(C)(C)O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
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ChEBI Ontology
Outgoing Papyriferic acid (CHEBI:7919) is a triterpenoid saponin (CHEBI:61778)
Synonym Source
Papyriferic acid KEGG COMPOUND
Manual Xrefs Databases
C00003752 KNApSAcK
C08632 KEGG COMPOUND
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Registry Number Type Source
78782-15-7 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014