| Properties | Image |
|---|
| MNX_ID | MNXM956303 |
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| reference | slm:000648688 |
| formula | C50H91NO9P |
| global charge | -1 |
| mol weight | 881.25 |
| InChIKey | XZVFBMUFSFTTPK-DQRIYFQXSA-M |
| InChI | InChI=1S/C50H92NO9P/c1-4-7-10-12-14-16-18-20-22-23-24-26-28-30-32-34-36-39-42-50(54)60-47(46-59-61(55,56)58-44-43-51-48(52)40-37-9-6-3)45-57-49(53)41-38-35-33-31-29-27-25-21-19-17-15-13-11-8-5-2/h15,17,21,25,29,31,47H,4-14,16,18-20,22-24,26-28,30,32-46H2,1-3H3,(H,51,52)(H,55,56)/p-1/b17-15-,25-21-,31-29-/t47-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C50H92NO9P/c1-4-7-10-12-14-16-18-20-22-23-24-26-28-30-32-34-36-39-42-50(54)60-47(46-59-61(55,56)58-44-43-51-48(52)40-37-9-6-3)45-57-49(53)41-38-35-33-31-29-27-25-21-19-17-15-13-11-8-5-2/h15,17,21,25,29,31,47H,4-14,16,18-20,22-24,26-28,30,32-46H2,1-3H3,(H,51,52)(H,55,56)/b17-15-,25-21-,31-29-/t47-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:12][CH2:14][CH2:16][CH2:18][CH2:20][CH2:22][CH2:23][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:39][CH2:42][C:50](=[O:54])[O:60][C@H:47]([CH2:45][O:57][C:49]([CH2:41][CH2:38][CH2:35][CH2:33]/[CH:31]=[CH:29]\[CH2:27]/[CH:25]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:8][CH2:5][CH3:2])=[O:53])[CH2:46][O:59][P:61]([OH:55])(=[O:56])[O:58][CH2:44][CH2:43][N:51]=[C:48]([CH2:40][CH2:37][CH2:9][CH2:6][CH3:3])[OH:52] |
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