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CHEBI:210669 - Hydrocycloprostatin A

ChEBI IDCHEBI:210669
ChEBI NameHydrocycloprostatin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H23N3O4
Net Charge0
Average Mass381.432
Monoisotopic Mass381.16886
SMILESCC(C)=C[C@H]1c2nc3ccccc3c2C[C@]2(O)C(=O)N3CCCC3(O)C(=O)N12
InChIInChI=1S/C21H23N3O4/c1-12(2)10-16-17-14(13-6-3-4-7-15(13)22-17)11-21(28)18(25)23-9-5-8-20(23,27)19(26)24(16)21/h3-4,6-7,10,16,22,27-28H,5,8-9,11H2,1-2H3/t16-,20?,21-/m0/s1
InChIKeyQZJUXQCZODUVGX-SVPGJFCKSA-N
ChEBI Ontology
Outgoing Relation(s)
Hydrocycloprostatin A (CHEBI:210669) is a β-carbolines (CHEBI:60834)
IUPAC Name 
(1S,12S)-1,15-dihydroxy-12-(2-methylprop-1-enyl)-10,13,19-triazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-3(11),4,6,8-tetraene-14,20-dione
Manual XrefsDatabases
78439149ChemSpider