Concept information
...
nitrogen molecular entity
organonitrogen compound
organonitrogen heterocyclic compound
bipyridines
...
organic cyclic compound
organic heterocyclic compound
organonitrogen heterocyclic compound
bipyridines
Preferred term
(2r,3r,3as,9bs)-3-(hydroxymethyl)-1-methyl-6-oxo-n-[(1s)-1-phenylethyl]-7-pyridin-4-yl-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C26H28N4O3
inchi
- InChI=1S/C26H28N4O3/c1-16(17-6-4-3-5-7-17)28-25(32)24-21(15-31)20-14-30-22(23(20)29(24)2)9-8-19(26(30)33)18-10-12-27-13-11-18/h3-13,16,20-21,23-24,31H,14-15H2,1-2H3,(H,28,32)/t16-,20+,21+,23-,24+/m0/s1
inchikey
- XRCXBUPUCMDVHO-QXGZYIMISA-N
mass
- 444.527
monoisotopicmass
- 444.21614
smiles
- C[C@@H](C1=CC=CC=C1)NC(=O)[C@H]2[C@@H]([C@H]3CN4C(=CC=C(C4=O)C5=CC=NC=C5)[C@H]3N2C)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:100755
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