Concept information
...
nitrogen molecular entity
organonitrogen compound
organonitrogen heterocyclic compound
quinolines
...
organic cyclic compound
organic heterocyclic compound
organonitrogen heterocyclic compound
quinolines
Preferred term
1-[(1s,2ar,8br)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(3-pyridinyl)ethanone
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C26H25N3O4
inchi
- InChI=1S/C26H25N3O4/c1-33-23-11-5-3-9-19(23)26(32)28-15-21-25(18-8-2-4-10-20(18)28)22(16-30)29(21)24(31)13-17-7-6-12-27-14-17/h2-12,14,21-22,25,30H,13,15-16H2,1H3/t21-,22+,25+/m0/s1
inchikey
- XLJJZSBNOHLXNG-SGIRGMQISA-N
mass
- 443.495
monoisotopicmass
- 443.18451
smiles
- COC1=CC=CC=C1C(=O)N2C[C@H]3[C@H]([C@H](N3C(=O)CC4=CN=CC=C4)CO)C5=CC=CC=C52
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:127947
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