| SpectraBase Spectrum ID |
Epkyse3Ont5 |
| Name |
[(4S,5S)-2-Keto-1,3-dimethyl-4,5-di(phenyl)-1,3-diaza-2$L^{5}-phosphacyclopent-2-yl]-[6-[[(4S,5S)-2-keto-1,3-dimethyl-4,5-di(phenyl)-1,3-diaza-2$L^{5}-phosphacyclopent-2-yl]-methyl-amino]hexyl]-methyl-amine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
712.378348997 u |
| Formula |
C40H54N6O2P2 |
| InChI |
InChI=1S/C40H54N6O2P2/c1-41(49(47)43(3)37(33-23-13-9-14-24-33)38(44(49)4)34-25-15-10-16-26-34)31-21-7-8-22-32-42(2)50(48)45(5)39(35-27-17-11-18-28-35)40(46(50)6)36-29-19-12-20-30-36/h9-20,23-30,37-40H,7-8,21-22,31-32H2,1-6H3/t37-,38-,39-,40-/m0/s1 |
| InChIKey |
URBBOCCHYOWDSE-YKKXUYLKSA-N |
| Molecular Weight |
712.860 g/mol |
| SMILES |
[C@@]1(N(P(N([C@]1(C1=CC=CC=C1)[H])C)(=O)N(C)CCCCCCN(C)P1(=O)N(C)[C@]([C@@](N1C)(C1=CC=CC=C1)[H])(C1=CC=CC=C1)[H])C)(C1=CC=CC=C1)[H] |
![[(4S,5S)-2-keto-1,3-dimethyl-4,5-di(phenyl)-1,3-diaza-2$l^{5}-phosphacyclopent-2-yl]-[6-[[(4S,5S)-2-keto-1,3-dimethyl-4,5-di(phenyl)-1,3-diaza-2$l^{5}-phosphacyclopent-2-yl]-methyl-amino]hexyl]-methyl-amine](/api/spectrum/Epkyse3Ont5/structure.png?h=300&w=458 "[(4S,5S)-2-keto-1,3-dimethyl-4,5-di(phenyl)-1,3-diaza-2$l^{5}-phosphacyclopent-2-yl]-[6-[[(4S,5S)-2-keto-1,3-dimethyl-4,5-di(phenyl)-1,3-diaza-2$l^{5}-phosphacyclopent-2-yl]-methyl-amino]hexyl]-methyl-amine")
