| Properties | Image |
|---|
| MNX_ID | MNXM180530 |
 |
| reference | slm:000006549 |
| formula | C51H87NO10P |
| global charge | -1 |
| mol weight | 905.228 |
| InChIKey | YUSZOXDTWQJTDP-RMTIWZMFSA-M |
| InChI | InChI=1S/C51H88NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-31-32-34-36-38-40-42-49(53)59-44-47(45-60-63(57,58)61-46-48(52)51(55)56)62-50(54)43-41-39-37-35-33-30-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24-25,27-28,47-48H,3-4,6,8-10,12,14-16,18,20,23,26,29-46,52H2,1-2H3,(H,55,56)(H,57,58)/p-1/b7-5-,13-11-,19-17-,22-21-,25-24-,28-27-/t47-,48+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C51H88NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-31-32-34-36-38-40-42-49(53)59-44-47(45-60-63(57,58)61-46-48(52)51(55)56)62-50(54)43-41-39-37-35-33-30-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24-25,27-28,47-48H,3-4,6,8-10,12,14-16,18,20,23,26,29-46,52H2,1-2H3,(H,55,56)(H,57,58)/b7-5-,13-11-,19-17-,22-21-,25-24-,28-27-/t47-,48+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH: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]/[CH:27]=[CH:28]\[CH2:29][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][C:49](=[O:53])[O:59][CH2:44][C@H:47]([CH2:45][O:60][P:63]([OH:57])(=[O:58])[O:61][CH2:46][C@@H:48]([C:51](=[O:55])[OH:56])[NH2:52])[O:62][C:50]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:30][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:54] |
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