CHEBI:3413 - Cardiospermin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Cardiospermin
ChEBI ID CHEBI:3413
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C11H17NO7
Net Charge 0
Average Mass 275.256
Monoisotopic Mass 275.10050
InChI InChI=1S/C11H17NO7/c1-5(3-13)6(2-12)18-11-10(17)9(16)8(15)7(4-14)19-11/h6-11,13-17H,1,3-4H2/t6-,7-,8-,9+,10-,11-/m1/s1
InChIKey MQTLCYHUTVTHFO-MPVQUNCYSA-N
SMILES OC[C@H]1O[C@@H](O[C@H](C#N)C(=C)CO)[C@H](O)[C@@H](O)[C@@H]1O
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 cyanogenic glycoside )
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ChEBI Ontology
Outgoing Cardiospermin (CHEBI:3413) is a cyanogenic glycoside (CHEBI:23436)
Synonym Source
Cardiospermin KEGG COMPOUND
Manual Xrefs Databases
C00001440 KNApSAcK
C08328 KEGG COMPOUND
View more database links
Registry Number Type Source
54525-10-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014