| Properties | Image |
|---|
| MNX_ID | MNXM343175 |
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| reference | slm:000456505 |
| formula | C19H33O16P2 |
| global charge | -3 |
| mol weight | 579.405 |
| InChIKey | JDGDLJKZPQOGAQ-GOVWPQFJSA-K |
| InChI | InChI=1S/C19H36O16P2/c1-3-4-5-6-7-8-13(21)33-12(9-31-11(2)20)10-32-37(29,30)35-19-16(24)14(22)15(23)18(17(19)25)34-36(26,27)28/h12,14-19,22-25H,3-10H2,1-2H3,(H,29,30)(H2,26,27,28)/p-3/t12-,14+,15+,16-,17-,18-,19+/m1/s1 |
| SMILES | CCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](OP(=O)([O-])[O-])[C@@H](O)[C@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C19H36O16P2/c1-3-4-5-6-7-8-13(21)33-12(9-31-11(2)20)10-32-37(29,30)35-19-16(24)14(22)15(23)18(17(19)25)34-36(26,27)28/h12,14-19,22-25H,3-10H2,1-2H3,(H,29,30)(H2,26,27,28)/t12-,14+,15+,16-,17-,18-,19+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][C:13](=[O:21])[O:33][C@H:12]([CH2:9][O:31][C:11]([CH3:2])=[O:20])[CH2:10][O:32][P:37]([OH:29])(=[O:30])[O:35][C@H:19]1[C@H:16]([OH:24])[C@@H:14]([OH:22])[C@H:15]([OH:23])[C@@H:18]([O:34][P:36]([OH:26])([OH:27])=[O:28])[C@H:17]1[OH:25] |
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