| Properties | Image |
|---|
| MNX_ID | MNXM148022 |
 |
| reference | metacycM:CPD-18035 |
| formula | C19H35N3O8PS*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)NCCSCCCCC)C([*])=O |
MNX internals
| InChI (mnx) | InChI=1/C21H42N3O8PS/c1-6-7-8-12-34-13-11-23-18(26)9-10-24-20(28)19(27)21(3,4)15-32-33(29,30)31-14-17(22-5)16(2)25/h17,19,22,27H,6-15H2,1-5H3,(H,23,26)(H,24,28)(H,29,30)/t17-,19-/m0/s1/i2+1,5+1 |
 |
| SMILES (mnx) | [CH3:1][CH2:6][CH2:7][CH2:8][CH2:12][S:34][CH2:13][CH2:11][N:23]=[C:18]([CH2:9][CH2:10][N:24]=[C:20]([C@@H:19]([C:21]([CH3:3])([CH3:4])[CH2:15][O:32][P:33]([OH:29])(=[O:30])[O:31][CH2:14][C@@H:17]([C:16]([13CH3:2])=[O:25])[NH:22][13CH3:5])[OH:27])[OH:28])[OH:26] |
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