CHEBI:2901 - Astrophylline

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ChEBI Name Astrophylline
ChEBI ID CHEBI:2901
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H26N2O
Net Charge 0
Average Mass 298.423
Monoisotopic Mass 298.205
InChI InChI=1S/C19H26N2O/c22-19(12-11-16-7-2-1-3-8-16)21-14-6-9-17(15-21)18-10-4-5-13-20-18/h1-3,7-8,11-12,17-18,20H,4-6,9-10,13-15H2/b12-11-/t17-,18+/m1/s1
InChIKey XIZYLQMCWHMQNP-ZHJNCLIFSA-N
SMILES O=C(\C=C/c1ccccc1)N1CCC[C@H](C1)C1CCCCN1
ChEBI Ontology
Outgoing Astrophylline (CHEBI:2901) is a cinnamamides (CHEBI:23247)
Astrophylline (CHEBI:2901) is a tertiary carboxamide (CHEBI:140326)
Synonym Source
Astrophylline KEGG COMPOUND
Manual Xrefs Databases
C00002022 KNApSAcK
C10131 KEGG COMPOUND
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Registry Number Type Source
5081-53-8 CAS Registry Number KEGG COMPOUND
Last Modified
07 March 2018