CHEBI:213180 - Cyanogramide C

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Cyanogramide C
ChEBI ID CHEBI:213180
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H23N3O3
Net Charge 0
Average Mass 401.466
Monoisotopic Mass 401.17394
InChI InChI=1S/C24H23N3O3/c1-24(30-3)26(14-13-16-9-5-4-6-10-16)22(28)20-15-18-17-11-7-8-12-19(17)25(2)21(18)23(29)27(20)24/h4-12,15H,13-14H2,1-3H3/t24-/m0/s1
InChIKey HJEQLHSAFDJJPU-DEOSSOPVSA-N
SMILES O=C1N2C(C(=O)N([C@@]2(OC)C)CCC3=CC=CC=C3)=CC4=C1N(C=5C=CC=CC45)C
Metabolite of Species Details
Actinoalloteichus (NCBI:txid65496) See: PubMed
ChEBI Ontology
Outgoing Cyanogramide C (CHEBI:213180) is a β-carbolines (CHEBI:60834)
IUPAC Name
12-methoxy-8,12-dimethyl-13-(2-phenylethyl)-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6,15-pentaene-10,14-dione
Manual Xref Database
88301855 ChemSpider
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