| Properties | Image |
|---|
| MNX_ID | MNXM299214 |
 |
| reference | slm:000004550 |
| formula | C48H81NO10P |
| global charge | -1 |
| mol weight | 863.147 |
| InChIKey | XAOPMIVTXNORCX-IOYDFOKJSA-M |
| InChI | InChI=1S/C48H82NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-29-31-33-35-37-39-46(50)56-41-44(42-57-60(54,55)58-43-45(49)48(52)53)59-47(51)40-38-36-34-32-30-27-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,23-24,26,28,44-45H,3-4,6,8-10,12,14-16,19,22,25,27,29-43,49H2,1-2H3,(H,52,53)(H,54,55)/p-1/b7-5-,13-11-,18-17-,21-20-,24-23-,28-26-/t44-,45+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C48H82NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-29-31-33-35-37-39-46(50)56-41-44(42-57-60(54,55)58-43-45(49)48(52)53)59-47(51)40-38-36-34-32-30-27-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,23-24,26,28,44-45H,3-4,6,8-10,12,14-16,19,22,25,27,29-43,49H2,1-2H3,(H,52,53)(H,54,55)/b7-5-,13-11-,18-17-,21-20-,24-23-,28-26-/t44-,45+/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:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:28]\[CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][C:46](=[O:50])[O:56][CH2:41][C@H:44]([CH2:42][O:57][P:60]([OH:54])(=[O:55])[O:58][CH2:43][C@@H:45]([C:48](=[O:52])[OH:53])[NH2:49])[O:59][C:47]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:27][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:51] |
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