CHEBI:3914 - Crinamine

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ChEBI Name Crinamine
ChEBI ID CHEBI:3914
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H19NO4
Net Charge 0
Average Mass 301.338
Monoisotopic Mass 301.13141
InChI InChI=1S/C17H19NO4/c1-20-11-2-3-17-12-6-14-13(21-9-22-14)4-10(12)7-18(8-16(17)19)15(17)5-11/h2-4,6,11,15-16,19H,5,7-9H2,1H3/t11-,15-,16-,17-/m0/s1
InChIKey YGPRSGKVLATIHT-SPOWBLRKSA-N
SMILES CO[C@@H]1C[C@@H]2N3C[C@H](O)[C@@]2(C=C1)c1cc2OCOc2cc1C3
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 Crinamine (CHEBI:3914) is a alkaloid (CHEBI:22315)
Synonyms Sources
(3alpha,5alpha,11R,13beta,19alpha)-1, 2-Didehydro-3-methoxycrinan-11-ol KEGG COMPOUND
Crinamine KEGG COMPOUND
Manual Xrefs Databases
C00001569 KNApSAcK
C08525 KEGG COMPOUND
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Registry Number Type Source
639-41-8 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014