| Properties | Image |
|---|
| MNX_ID | MNXM89949 |
 |
| reference | biggM:hdeACP |
| formula | C27H49N2O8PS* |
| global charge | -1 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]OP(=O)([O-])OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCC=CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C28H53N2O8PS/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(32)40-22-21-29-24(31)19-20-30-27(34)26(33)28(2,3)23-38-39(35,36)37-4/h10-11,26,33H,5-9,12-23H2,1-4H3,(H,29,31)(H,30,34)(H,35,36)/b11-10?/t26?/i4+1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:10]=[CH:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][C:25](=[O:32])[S:40][CH2:22][CH2:21][N:29]=[C:24]([CH2:19][CH2:20][N:30]=[C:27]([CH:26]([C:28]([CH3:2])([CH3:3])[CH2:23][O:38][P:39]([OH:35])(=[O:36])[O:37][13CH3:4])[OH:33])[OH:34])[OH:31] |
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