CHEBI:80683 - Pumiloside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Pumiloside
ChEBI ID CHEBI:80683
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H28N2O9
Net Charge 0
Average Mass 512.50850
Monoisotopic Mass 512.17948
InChI InChI=1S/C26H28N2O9/c1-2-11-13-7-17-19-14(20(30)12-5-3-4-6-16(12)27-19)8-28(17)24(34)15(13)10-35-25(11)37-26-23(33)22(32)21(31)18(9-29)36-26/h2-6,10-11,13,17-18,21-23,25-26,29,31-33H,1,7-9H2,(H,27,30)/t11-,13+,17+,18-,21-,22+,23-,25+,26+/m1/s1
InChIKey ODQBQUXGRYBRTP-FWMZWJSFSA-N
SMILES OC[C@H]1O[C@@H](O[C@@H]2OC=C3[C@@H](C[C@@H]4N(Cc5c4[nH]c4ccccc4c5=O)C3=O)[C@H]2C=C)[C@H](O)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing Pumiloside (CHEBI:80683) is a glycoside (CHEBI:24400)
Manual Xref Database
C16723 KEGG COMPOUND
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