CHEBI:3957 - Cularimine

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ChEBI Name Cularimine
ChEBI ID CHEBI:3957
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H21NO4
Net Charge 0
Average Mass 327.375
Monoisotopic Mass 327.14706
InChI InChI=1S/C19H21NO4/c1-21-14-5-4-11-6-7-20-13-8-12-9-16(22-2)17(23-3)10-15(12)24-19(14)18(11)13/h4-5,9-10,13,20H,6-8H2,1-3H3/t13-/m0/s1
InChIKey KTKYPZQQXSZXCE-ZDUSSCGKSA-N
SMILES COc1cc2C[C@@H]3NCCc4ccc(OC)c(Oc2cc1OC)c34
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 alkaloid )
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ChEBI Ontology
Outgoing Cularimine (CHEBI:3957) is a alkaloid (CHEBI:22315)
Synonym Source
Cularimine KEGG COMPOUND
Manual Xrefs Databases
C00001841 KNApSAcK
C09410 KEGG COMPOUND
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Registry Number Type Source
479-42-5 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014