Try beta.chemspider
- Charge
- 1 of 1 defined stereocentres
- Non-standard isotope
Disodium (2S)-2-({4-[2-(2-amino-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}amino)(~2~H_5_)pentanedioate
C1=C(C=CC(=C1)C(=O)N[C@@]([2H])(C([2H])([2H])C([2H])([2H])C(=O)[O-])C(=O)O)CCC2=CNC3=C2C(=NC(=N)N3)[O-].[Na+].[Na+] [2H][C@@](C(=O)[O-])(C([2H])([2H])C([2H])([2H])C(=O)[O-])NC(=O)c1ccc(cc1)CCc2c[nH]c3c2c(=O)nc([nH]3)N.[Na+].[Na+]
InChI=1S/C20H21N5O6.2Na/c21-20-24-16-15(18(29)25-20)12(9-22-16)6-3-10-1-4-11(5-2-10)17(28)23-13(19(30)31)7-8-14(26)27;;/h1-2,4-5,9,13H,3,6-8H2,(H,23,28)(H,26,27)(H,30,31)(H4,21,22,24,25,29);;/q;2*+1/p-2/t13-;;/m0../s1/i7D2,8D2,13D;;
NYDXNILOWQXUOF-GDOLQUNCSA-L
CSID:58783766, http://www.chemspider.com/Chemical-Structure.58783766.html (accessed 05:35, Jun 5, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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