Concept information
Preferred term
(8R,9S) 9 [[3,4 dihydro 2H 1,5 benzodioxepin 6 ylmethyl(methyl)amino] methyl] 6 [(2R) 1 hydroxypropan 2 yl] 8 methyl 10 oxa 1,6,13,14 tetrazabicyclo[10.2](10.2) دی سیکلو[10.2]، 1/1.
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C26H39N5O5
inchi
- InChI=1S/C26H39N5O5/c1-19-13-31(20(2)17-32)25(33)9-5-10-30-15-22(27-28-30)18-36-24(19)16-29(3)14-21-7-4-8-23-26(21)35-12-6-11-34-23/h4,7-8,15,19-20,24,32H,5-6,9-14,16-18H2,1-3H3/t19-,20-,24-/m1/s1
inchikey
- ATOJIXFYNQCGDG-YOSAUDMPSA-N
mass
- 501.619
monoisotopicmass
- 501.29512
smiles
- C[C@@H]1CN(C(=O)CCCN2C=C(CO[C@@H]1CN(C)CC3=C4C(=CC=C3)OCCCO4)N=N2)[C@H](C)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:95845
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