| Properties | Image |
|---|
| MNX_ID | MNXM343036 |
 |
| reference | slm:000430903 |
| formula | C23H40O19P3 |
| global charge | -5 |
| mol weight | 713.476 |
| InChIKey | JSMDSONLCUVJRM-UHUQPAHKSA-I |
| InChI | InChI=1S/C23H45O19P3/c1-3-4-5-6-7-8-9-10-11-12-17(25)39-16(13-37-15(2)24)14-38-45(35,36)42-21-18(26)19(27)22(40-43(29,30)31)23(20(21)28)41-44(32,33)34/h16,18-23,26-28H,3-14H2,1-2H3,(H,35,36)(H2,29,30,31)(H2,32,33,34)/p-5/t16-,18-,19-,20+,21+,22+,23+/m1/s1 |
| SMILES | CCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](O)[C@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C23H45O19P3/c1-3-4-5-6-7-8-9-10-11-12-17(25)39-16(13-37-15(2)24)14-38-45(35,36)42-21-18(26)19(27)22(40-43(29,30)31)23(20(21)28)41-44(32,33)34/h16,18-23,26-28H,3-14H2,1-2H3,(H,35,36)(H2,29,30,31)(H2,32,33,34)/t16-,18-,19-,20+,21+,22+,23+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][C:17](=[O:25])[O:39][C@H:16]([CH2:13][O:37][C:15]([CH3:2])=[O:24])[CH2:14][O:38][P:45]([OH:35])(=[O:36])[O:42][C@H:21]1[C@H:18]([OH:26])[C@@H:19]([OH:27])[C@H:22]([O:40][P:43]([OH:29])([OH:30])=[O:31])[C@@H:23]([O:41][P:44]([OH:32])([OH:33])=[O:34])[C@H:20]1[OH:28] |
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