CHEBI:9075 - Secologanate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Secologanate
ChEBI ID CHEBI:9075
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H22O10
Net Charge 0
Average Mass 374.341
Monoisotopic Mass 374.12130
InChI InChI=1S/C16H22O10/c1-2-7-8(3-4-17)9(14(22)23)6-24-15(7)26-16-13(21)12(20)11(19)10(5-18)25-16/h2,4,6-8,10-13,15-16,18-21H,1,3,5H2,(H,22,23)/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1
InChIKey PUEUIRDVQIKCCG-ZASXJUAOSA-N
SMILES OC[C@H]1O[C@@H](O[C@@H]2OC=C([C@@H](CC=O)[C@H]2C=C)C(O)=O)[C@H](O)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing Secologanate (CHEBI:9075) is a terpene glycoside (CHEBI:61777)
Synonym Source
Secologanate KEGG COMPOUND
Manual Xref Database
C01957 KEGG COMPOUND
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Last Modified
28 July 2014