| Properties | Image |
MNX_ID | MNXM6460 |
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reference | metacycM:tRNA-pseudouridine-31 |
formula | C9H10N2O12P2*2 |
global charge | -2 |
mol weight | |
InChIKey | |
InChI | |
SMILES | [*]OP(=O)([O-])OC[C@H]1O[C@@H](C2=CNC(=O)NC2=O)[C@H](O)[C@@H]1OP(=O)([O-])O[*] |
MNX internals
InChI (mnx) | InChI=1/C11H18N2O12P2/c1-21-26(17,18)23-4-6-9(25-27(19,20)22-2)7(14)8(24-6)5-3-12-11(16)13-10(5)15/h3,6-9,14H,4H2,1-2H3,(H,17,18)(H,19,20)(H2,12,13,15,16)/t6-,7+,8+,9-/m1/s1/i1+1,2+1 |
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SMILES (mnx) | [13CH3:1][O:21][P:26]([OH:17])(=[O:18])[O:23][CH2:4][C@@H:6]1[C@@H:9]([O:25][P:27]([OH:19])(=[O:20])[O:22][13CH3:2])[C@@H:7]([OH:14])[C@H:8]([C:5]2=[CH:3][N:12]=[C:11]([OH:16])[N:13]=[C:10]2[OH:15])[O:24]1 |
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