Concept information
...
nitrogen molecular entity
organonitrogen compound
organonitrogen heterocyclic compound
quinolines
...
organic cyclic compound
organic heterocyclic compound
organonitrogen heterocyclic compound
quinolines
Preferred term
1-[(3as,4r,9br)-4-(hydroxymethyl)-8-(3-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2h-pyrrolo[3,2-c]quinolin-1-yl]-2-pyridin-4-ylethanone
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C27H29N3O3
inchi
- InChI=1S/C27H29N3O3/c1-29-24-7-6-20(19-4-3-5-21(15-19)33-2)16-23(24)27-22(25(29)17-31)10-13-30(27)26(32)14-18-8-11-28-12-9-18/h3-9,11-12,15-16,22,25,27,31H,10,13-14,17H2,1-2H3/t22-,25+,27-/m1/s1
inchikey
- BUQGVIZHJOSDOL-BUALBWRZSA-N
mass
- 443.538
monoisotopicmass
- 443.22089
smiles
- CN1[C@H]([C@H]2CCN([C@H]2C3=C1C=CC(=C3)C4=CC(=CC=C4)OC)C(=O)CC5=CC=NC=C5)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:130186
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