CHEBI:216338 - (11R)-7-chloro-11-hydroxy-20-methoxy-N,3-dimethyl-12-oxo-3,13-diazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(20),2(10),4(9),5,7,14,16,18-octaene-11-carboxamide

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ChEBI Name (11R)-7-chloro-11-hydroxy-20-methoxy-N,3-dimethyl-12-oxo-3,13-diazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(20),2(10),4(9),5,7,14,16,18-octaene-11-carboxamide
ChEBI ID CHEBI:216338
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H18ClN3O4
Net Charge 0
Average Mass 423.850
Monoisotopic Mass 423.09858
InChI InChI=1S/C22H18ClN3O4/c1-24-20(27)22(29)16-13-10-11(23)8-9-14(13)25(2)17(16)18-19(30-3)12-6-4-5-7-15(12)26(18)21(22)28/h4-10,29H,1-3H3,(H,24,27)/t22-/m1/s1
InChIKey ZZMBWELYHDIPSE-JOCHJYFZSA-N
SMILES ClC1=CC2=C(N(C)C3=C2[C@](O)(C(=O)N4C3=C(OC)C=5C=CC=CC45)C(=O)NC)C=C1
ChEBI Ontology
Outgoing (11R)-7-chloro-11-hydroxy-20-methoxy-N,3-dimethyl-12-oxo-3,13-diazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(20),2(10),4(9),5,7,14,16,18-octaene-11-carboxamide (CHEBI:216338) is a β-carbolines (CHEBI:60834)
IUPAC Name
(11R)-7-chloro-11-hydroxy-20-methoxy-N,3-dimethyl-12-oxo-3,13-diazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(20),2(10),4(9),5,7,14,16,18-octaene-11-carboxamide
Manual Xref Database
78439855 ChemSpider
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