| Properties | Image |
|---|
| MNX_ID | MNXM343007 |
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| reference | slm:000443695 |
| formula | C21H35O22P4 |
| global charge | -7 |
| mol weight | 763.385 |
| InChIKey | ZGBOHGIYKUUBMC-GFZFYRMWSA-G |
| InChI | InChI=1S/C21H42O22P4/c1-3-4-5-6-7-8-9-10-15(23)39-14(11-37-13(2)22)12-38-47(35,36)43-18-16(24)19(40-44(26,27)28)21(42-46(32,33)34)20(17(18)25)41-45(29,30)31/h14,16-21,24-25H,3-12H2,1-2H3,(H,35,36)(H2,26,27,28)(H2,29,30,31)(H2,32,33,34)/p-7/t14-,16+,17+,18-,19+,20-,21-/m1/s1 |
| SMILES | CCCCCCCCCC(=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](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C21H42O22P4/c1-3-4-5-6-7-8-9-10-15(23)39-14(11-37-13(2)22)12-38-47(35,36)43-18-16(24)19(40-44(26,27)28)21(42-46(32,33)34)20(17(18)25)41-45(29,30)31/h14,16-21,24-25H,3-12H2,1-2H3,(H,35,36)(H2,26,27,28)(H2,29,30,31)(H2,32,33,34)/t14-,16+,17+,18-,19+,20-,21-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][C:15](=[O:23])[O:39][C@H:14]([CH2:11][O:37][C:13]([CH3:2])=[O:22])[CH2:12][O:38][P:47]([OH:35])(=[O:36])[O:43][C@@H:18]1[C@H:16]([OH:24])[C@H:19]([O:40][P:44]([OH:26])([OH:27])=[O:28])[C@@H:21]([O:42][P:46]([OH:32])([OH:33])=[O:34])[C@H:20]([O:41][P:45]([OH:29])([OH:30])=[O:31])[C@H:17]1[OH:25] |
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