| Properties | Image |
|---|
| MNX_ID | MNXM344506 |
 |
| reference | slm:000462989 |
| formula | C26H47O16P2 |
| global charge | -3 |
| mol weight | 677.594 |
| InChIKey | PTSKFAGDRNPRFS-GTNOXYRFSA-K |
| InChI | InChI=1S/C26H50O16P2/c1-3-5-6-7-8-9-10-11-12-13-15-20(28)40-18(16-38-19(27)14-4-2)17-39-44(36,37)42-26-23(31)21(29)25(22(30)24(26)32)41-43(33,34)35/h18,21-26,29-32H,3-17H2,1-2H3,(H,36,37)(H2,33,34,35)/p-3/t18-,21-,22+,23-,24-,25+,26+/m1/s1 |
| SMILES | CCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](O)[C@H](OP(=O)([O-])[O-])[C@@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C26H50O16P2/c1-3-5-6-7-8-9-10-11-12-13-15-20(28)40-18(16-38-19(27)14-4-2)17-39-44(36,37)42-26-23(31)21(29)25(22(30)24(26)32)41-43(33,34)35/h18,21-26,29-32H,3-17H2,1-2H3,(H,36,37)(H2,33,34,35)/t18-,21-,22+,23-,24-,25+,26+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:15][C:20](=[O:28])[O:40][C@H:18]([CH2:16][O:38][C:19]([CH2:14][CH2:4][CH3:2])=[O:27])[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:25]([O:41][P:43]([OH:33])([OH:34])=[O:35])[C@@H:22]([OH:30])[C@H:24]1[OH:32] |
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