| Properties | Image |
MNX_ID | MNXM736996 |
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reference | sabiorkM:1814 |
formula | C9H19N2O8P |
global charge | 0 |
mol weight | 314.231 |
InChIKey | BOLRFGHAQSWKGO-QYNIQEEDSA-N |
InChI | InChI=1S/C9H19N2O8P/c1-5(10)8(13)11-6(2)9(14)19-7(3-12)4-18-20(15,16)17/h5-7,12H,3-4,10H2,1-2H3,(H,11,13)(H2,15,16,17)/t5-,6-,7+/m1/s1 |
SMILES | C[C@@H](N)C(O)=N[C@H](C)C(=O)O[C@@H](CO)COP(=O)(O)O |
MNX internals
InChI (mnx) | InChI=1/C9H19N2O8P/c1-5(10)8(13)11-6(2)9(14)19-7(3-12)4-18-20(15,16)17/h5-7,12H,3-4,10H2,1-2H3,(H,11,13)(H2,15,16,17)/t5-,6-,7+/m1/s1 |
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SMILES (mnx) | [CH3:1][C@H:5]([C:8](=[N:11][C@H:6]([CH3:2])[C:9](=[O:14])[O:19][C@@H:7]([CH2:3][OH:12])[CH2:4][O:18][P:20]([OH:15])([OH:16])=[O:17])[OH:13])[NH2:10] |
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