Sulbactum Sodium(63-38-7) 13C NMR
Product NameSulbactum Sodium
CAS63-38-7
Molecular FormulaC9H15N3O11P2
Molecular Weight403.18
InChIInChI=1S/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
InChIKey ZWIADYZPOWUWEW-XVFCMESISA-N
SmilesC(OP(=O)(O)OP(O)(O)=O)[C@H]1O[C@@H](N2C=CC(N)=NC2=O)[C@H](O)[C@@H]1O
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ppm Int. Assign.
159.81 634 1 149.03 600 2 144.67 795 3 95.97 706 4 90.12 868 5 84.08 331 P 6 83.70 374 P 6 74.95 953 7 69.77 1000 8 65.12 369 P 9 64.95 313 P 9Spectral Code: 13C NMR : in D2O
