CHEBI:2725 - Angustine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Angustine
ChEBI ID CHEBI:2725
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H15N3O
Net Charge 0
Average Mass 313.353
Monoisotopic Mass 313.12151
InChI InChI=1S/C20H15N3O/c1-2-12-10-21-11-16-15(12)9-18-19-14(7-8-23(18)20(16)24)13-5-3-4-6-17(13)22-19/h2-6,9-11,22H,1,7-8H2
InChIKey FACXQEOSOVJIPD-UHFFFAOYSA-N
SMILES C=Cc1cncc2c1cc1-c3[nH]c4ccccc4c3CCn1c2=O
ChEBI Ontology
Outgoing Angustine (CHEBI:2725) is a β-carbolines (CHEBI:60834)
Synonym Source
Angustine KEGG COMPOUND
Manual Xrefs Databases
C00001685 KNApSAcK
C09032 KEGG COMPOUND
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Registry Number Type Source
40041-96-1 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014