| Properties | Image |
| MNX_ID | MNXM345740 |
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| reference | slm:000475854 |
| formula | C22H41O13P2 |
| global charge | -3 |
| mol weight | 575.505 |
| InChIKey | SSJVGXJQESFCLT-VQTJNVASSA-K |
| InChI | InChI=1S/C22H44O13P2/c1-3-5-7-8-9-10-12-13-21(24)31-17-20(35-22(25)14-11-6-4-2)18-34-37(29,30)33-16-19(23)15-32-36(26,27)28/h19-20,23H,3-18H2,1-2H3,(H,29,30)(H2,26,27,28)/p-3/t19-,20+/m0/s1 |
| SMILES | CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-])OC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C22H44O13P2/c1-3-5-7-8-9-10-12-13-21(24)31-17-20(35-22(25)14-11-6-4-2)18-34-37(29,30)33-16-19(23)15-32-36(26,27)28/h19-20,23H,3-18H2,1-2H3,(H,29,30)(H2,26,27,28)/t19-,20+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:9][CH2:10][CH2:12][CH2:13][C:21](=[O:24])[O:31][CH2:17][C@H:20]([CH2:18][O:34][P:37]([OH:29])(=[O:30])[O:33][CH2:16][C@H:19]([CH2:15][O:32][P:36]([OH:26])([OH:27])=[O:28])[OH:23])[O:35][C:22]([CH2:14][CH2:11][CH2:6][CH2:4][CH3:2])=[O:25] |
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