| Properties | Image |
| MNX_ID | MNXM8992 |
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| reference | metacycM:PchF |
| formula | C14H25N3O8PS*2 |
| global charge | -1 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]N[C@@H](COP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCS)C([*])=O |
MNX internals
| InChI (mnx) | InChI=1/C16H32N3O8PS/c1-11(20)12(17-4)9-26-28(24,25)27-10-16(2,3)14(22)15(23)19-6-5-13(21)18-7-8-29/h12,14,17,22,29H,5-10H2,1-4H3,(H,18,21)(H,19,23)(H,24,25)/t12-,14-/m0/s1/i1+1,4+1 |
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| SMILES (mnx) | [13CH3:1][C:11]([CH3:2])([CH2:7][NH:17][N:18]([O:27][O:20][O:21]([O:22]([OH:23])=[O:25])[O:24][OH:26])([PH2:28])=[S:29])[C@@H:9]([C:10]([CH2:13][13CH2:4][CH2:3][C:8]([CH2:12][CH2:5][CH2:6][NH2:19])=[CH2:14])=[CH2:16])[CH3:15] |
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