| Properties | Image |
|---|
| MNX_ID | MNXM342294 |
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| reference | slm:000443648 |
| formula | C26H45O22P4 |
| global charge | -7 |
| mol weight | 833.52 |
| InChIKey | OKJVGPVXTFWLRO-BDHVTRLXSA-G |
| InChI | InChI=1S/C26H52O22P4/c1-17(2)13-11-9-7-5-4-6-8-10-12-14-20(28)44-19(15-42-18(3)27)16-43-52(40,41)48-23-21(29)24(45-49(31,32)33)26(47-51(37,38)39)25(22(23)30)46-50(34,35)36/h17,19,21-26,29-30H,4-16H2,1-3H3,(H,40,41)(H2,31,32,33)(H2,34,35,36)(H2,37,38,39)/p-7/t19-,21+,22+,23-,24+,25-,26-/m1/s1 |
| SMILES | CC(=O)OC[C@H](COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O)OC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C26H52O22P4/c1-17(2)13-11-9-7-5-4-6-8-10-12-14-20(28)44-19(15-42-18(3)27)16-43-52(40,41)48-23-21(29)24(45-49(31,32)33)26(47-51(37,38)39)25(22(23)30)46-50(34,35)36/h17,19,21-26,29-30H,4-16H2,1-3H3,(H,40,41)(H2,31,32,33)(H2,34,35,36)(H2,37,38,39)/t19-,21+,22+,23-,24+,25-,26-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH:17]([CH3:2])[CH2:13][CH2:11][CH2:9][CH2:7][CH2:5][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][C:20](=[O:28])[O:44][C@H:19]([CH2:15][O:42][C:18]([CH3:3])=[O:27])[CH2:16][O:43][P:52]([OH:40])(=[O:41])[O:48][C@@H:23]1[C@H:21]([OH:29])[C@H:24]([O:45][P:49]([OH:31])([OH:32])=[O:33])[C@@H:26]([O:47][P:51]([OH:37])([OH:38])=[O:39])[C@H:25]([O:46][P:50]([OH:34])([OH:35])=[O:36])[C@H:22]1[OH:30] |
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