| Properties | Image |
|---|
| MNX_ID | MNXM955368 |
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| reference | slm:000647753 |
| formula | C57H105NO9P |
| global charge | -1 |
| mol weight | 979.439 |
| InChIKey | OOFGIIYZKGZBSJ-AMAPVIRTSA-M |
| InChI | InChI=1S/C57H106NO9P/c1-4-7-10-13-16-19-21-23-25-26-27-28-30-32-34-37-40-43-46-49-57(61)67-54(52-64-56(60)48-45-42-39-36-33-31-29-24-22-20-17-14-11-8-5-2)53-66-68(62,63)65-51-50-58-55(59)47-44-41-38-35-18-15-12-9-6-3/h17,20,24,29,33,36,54H,4-16,18-19,21-23,25-28,30-32,34-35,37-53H2,1-3H3,(H,58,59)(H,62,63)/p-1/b20-17-,29-24-,36-33-/t54-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C57H106NO9P/c1-4-7-10-13-16-19-21-23-25-26-27-28-30-32-34-37-40-43-46-49-57(61)67-54(52-64-56(60)48-45-42-39-36-33-31-29-24-22-20-17-14-11-8-5-2)53-66-68(62,63)65-51-50-58-55(59)47-44-41-38-35-18-15-12-9-6-3/h17,20,24,29,33,36,54H,4-16,18-19,21-23,25-28,30-32,34-35,37-53H2,1-3H3,(H,58,59)(H,62,63)/b20-17-,29-24-,36-33-/t54-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21][CH2:23][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:32][CH2:34][CH2:37][CH2:40][CH2:43][CH2:46][CH2:49][C:57](=[O:61])[O:67][C@H:54]([CH2:52][O:64][C:56]([CH2:48][CH2:45][CH2:42][CH2:39]/[CH:36]=[CH:33]\[CH2:31]/[CH:29]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:60])[CH2:53][O:66][P:68]([OH:62])(=[O:63])[O:65][CH2:51][CH2:50][N:58]=[C:55]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:59] |
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