| Properties | Image |
|---|
| MNX_ID | MNXM360053 |
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| reference | slm:000007371 |
| formula | C49H87NO10P |
| global charge | -1 |
| mol weight | 881.206 |
| InChIKey | AZTQMDOWFFCDSX-PVMZUFMPSA-M |
| InChI | InChI=1S/C49H88NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-48(52)60-45(43-58-61(55,56)59-44-46(50)49(53)54)42-57-47(51)40-38-36-34-32-30-28-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,45-46H,3-10,12,14-16,18,20,23,26-44,50H2,1-2H3,(H,53,54)(H,55,56)/p-1/b13-11-,19-17-,22-21-,25-24-/t45-,46+/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C49H88NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-48(52)60-45(43-58-61(55,56)59-44-46(50)49(53)54)42-57-47(51)40-38-36-34-32-30-28-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,45-46H,3-10,12,14-16,18,20,23,26-44,50H2,1-2H3,(H,53,54)(H,55,56)/b13-11-,19-17-,22-21-,25-24-/t45-,46+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:48](=[O:52])[O:60][C@H:45]([CH2:42][O:57][C:47]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:51])[CH2:43][O:58][P:61]([OH:55])(=[O:56])[O:59][CH2:44][C@@H:46]([C:49](=[O:53])[OH:54])[NH2:50] |
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