CHEBI:7506 - Neolinustatin

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ChEBI Name Neolinustatin
ChEBI ID CHEBI:7506
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H29NO11
Net Charge 0
Average Mass 423.413
Monoisotopic Mass 423.17406
InChI InChI=1S/C17H29NO11/c1-3-17(2,6-18)29-16-14(25)12(23)10(21)8(28-16)5-26-15-13(24)11(22)9(20)7(4-19)27-15/h7-16,19-25H,3-5H2,1-2H3/t7-,8-,9-,10-,11+,12+,13-,14-,15-,16+,17-/m1/s1
InChIKey WOSYVGNDRYBQCQ-BARGLTKPSA-N
SMILES CC[C@@](C)(O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)C#N
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 Neolinustatin (CHEBI:7506) is a cyanogenic glycoside (CHEBI:23436)
Synonym Source
Neolinustatin KEGG COMPOUND
Manual Xrefs Databases
C00001450 KNApSAcK
C08336 KEGG COMPOUND
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Registry Number Type Source
72229-42-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014