Concept information
...
nitrogen molecular entity
organonitrogen compound
organonitrogen heterocyclic compound
quinolines
...
organic cyclic compound
organic heterocyclic compound
organonitrogen heterocyclic compound
quinolines
Preferred term
[(3ar,4r,9br)-4-(hydroxymethyl)-8-(3-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(2-pyrazinyl)methanone
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C24H24N4O3
inchi
- InChI=1S/C24H24N4O3/c1-31-17-4-2-3-15(11-17)16-5-6-20-19(12-16)23-18(22(14-29)27-20)7-10-28(23)24(30)21-13-25-8-9-26-21/h2-6,8-9,11-13,18,22-23,27,29H,7,10,14H2,1H3/t18-,22+,23-/m1/s1
inchikey
- GMDSXMKSKJEZHK-YFXJRYMSSA-N
mass
- 416.473
monoisotopicmass
- 416.18484
smiles
- COC1=CC=CC(=C1)C2=CC3=C(C=C2)N[C@H]([C@@H]4[C@H]3N(CC4)C(=O)C5=NC=CN=C5)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:128241
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