| Properties | Image |
MNX_ID | MNXM735701 |
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reference | metacycM:Nucleoside-Diphosphates |
formula | C5H7O9P2*2 |
global charge | -3 |
mol weight | |
InChIKey | |
InChI | |
SMILES | [*][C@@H]1[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])[O-])O[C@H]1[*] |
MNX internals
InChI (mnx) | InChI=1/C7H16O9P2/c1-4-5(2)15-6(7(4)8)3-14-18(12,13)16-17(9,10)11/h4-8H,3H2,1-2H3,(H,12,13)(H2,9,10,11)/t4-,5-,6+,7-/m0/s1/i1+1,2+1 |
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SMILES (mnx) | [13CH3:1][C@H:4]1[C@H:5]([13CH3:2])[O:15][C@H:6]([CH2:3][O:14][P:18]([OH:12])(=[O:13])[O:16][P:17]([OH:9])([OH:10])=[O:11])[C@H:7]1[OH:8] |
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