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- 1 of 1 defined stereocentres
N-{4-[2-(2-Amino-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}-D-glutamic acid hydrate (1:1)
O.NC1NC2NC=C(CCC3C=CC(=CC=3)C(=O)N[C@H](CCC(O)=O)C(O)=O)C=2C(=O)N=1
InChI=1S/C20H21N5O6.H2O/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);1H2/t13-;/m1./s1
NBNBOZLBWLNZHB-BTQNPOSSSA-N
CSID:77499081, http://www.chemspider.com/Chemical-Structure.77499081.html (accessed 18:57, Jun 15, 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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