Concept information
Preferred term
N [[(2R,3S) 10 (dimethylamino) 5 [(2R) 1 hydroxypropan 2 yl] 3 methyl 6 oxo 3,4 dihydro 2H 1,5 benzoxazocin 2 yl]methyl] N,4 dimethylbenzenesulfonamide
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C25H35N3O5S
inchi
- InChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19+,23-/m0/s1
inchikey
- ANXKOFDVDMSSFK-YYDVJCTNSA-N
mass
- 489.630
monoisotopicmass
- 489.22974
smiles
- C[C@H]1CN(C(=O)C2=C(C(=CC=C2)N(C)C)O[C@H]1CN(C)S(=O)(=O)C3=CC=C(C=C3)C)[C@H](C)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:111803
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