CHEBI:202132 - Dnacin B1

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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 Dnacin B1
ChEBI ID CHEBI:202132
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H24N4O5
Net Charge 0
Average Mass 388.424
Monoisotopic Mass 388.17467
InChI InChI=1S/C19H24N4O5/c1-21-9-4-7-14(21)16-15(22-2-3-28-19(7)22)13-11(25)5-8(20)17(26)12(13)10(6-24)23(16)18(9)27/h5,7,9-10,14-16,18-19,24,27H,2-4,6,20H2,1H3
InChIKey BJHZMIHVUMIBSL-UHFFFAOYSA-N
SMILES O=C1C(N)=CC(=O)C2=C1C(N3C(O)C4CC5C6N(C2C3C5N4C)CCO6)CO
Metabolite of Species Details
Nocardia (NCBI:txid1817) See: PubMed
ChEBI Ontology
Outgoing Dnacin B1 (CHEBI:202132) is a isoquinolines (CHEBI:24922)
IUPAC Name
13-amino-21-hydroxy-16-(hydroxymethyl)-20-methyl-5-oxa-8,17,20-triazahexacyclo[15.3.1.03,19.04,8.09,18.010,15]henicosa-10(15),12-diene-11,14-dione
Manual Xref Database
2342777 ChemSpider
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