| Properties | Image |
|---|
| MNX_ID | MNXM338291 |
 |
| reference | slm:000456350 |
| formula | C26H45O16P2 |
| global charge | -3 |
| mol weight | 675.578 |
| InChIKey | HNMHHVHXYRRAPI-HYVNCANGSA-K |
| InChI | InChI=1S/C26H48O16P2/c1-3-5-6-7-8-9-10-11-12-13-14-15-20(28)38-16-18(40-19(27)4-2)17-39-44(36,37)42-26-23(31)21(29)22(30)25(24(26)32)41-43(33,34)35/h7-8,18,21-26,29-32H,3-6,9-17H2,1-2H3,(H,36,37)(H2,33,34,35)/p-3/b8-7-/t18-,21+,22+,23-,24-,25-,26+/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@H](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)OC(=O)CC |
MNX internals
| InChI (mnx) | InChI=1/C26H48O16P2/c1-3-5-6-7-8-9-10-11-12-13-14-15-20(28)38-16-18(40-19(27)4-2)17-39-44(36,37)42-26-23(31)21(29)22(30)25(24(26)32)41-43(33,34)35/h7-8,18,21-26,29-32H,3-6,9-17H2,1-2H3,(H,36,37)(H2,33,34,35)/b8-7-/t18-,21+,22+,23-,24-,25-,26+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6]/[CH:7]=[CH:8]\[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][C:20](=[O:28])[O:38][CH2:16][C@H:18]([CH2:17][O:39][P:44]([OH:36])(=[O:37])[O:42][C@H:26]1[C@H:23]([OH:31])[C@@H:21]([OH:29])[C@H:22]([OH:30])[C@@H:25]([O:41][P:43]([OH:33])([OH:34])=[O:35])[C@H:24]1[OH:32])[O:40][C:19]([CH2:4][CH3:2])=[O:27] |
|