| Properties | Image |
| MNX_ID | MNXM158855 |
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| reference | chebi:79009 |
| formula | C28H49N3O9PS*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)NCCSC(=O)CCCCCCC/C=C\CCCC)C([*])=O |
MNX internals
| InChI (mnx) | InChI=1/C30H56N3O9PS/c1-6-7-8-9-10-11-12-13-14-15-16-17-27(36)44-21-20-32-26(35)18-19-33-29(38)28(37)30(3,4)23-42-43(39,40)41-22-25(31-5)24(2)34/h9-10,25,28,31,37H,6-8,11-23H2,1-5H3,(H,32,35)(H,33,38)(H,39,40)/b10-9-/t25-,28-/m0/s1/i2+1,5+1 |
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| SMILES (mnx) | [CH3:1][CH2:6][CH2:7][CH2:8]/[CH:9]=[CH:10]\[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][C:27](=[O:36])[S:44][CH2:21][CH2:20][N:32]=[C:26]([CH2:18][CH2:19][N:33]=[C:29]([C@@H:28]([C:30]([CH3:3])([CH3:4])[CH2:23][O:42][P:43]([OH:39])(=[O:40])[O:41][CH2:22][C@@H:25]([C:24]([13CH3:2])=[O:34])[NH:31][13CH3:5])[OH:37])[OH:38])[OH:35] |
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