| Properties | Image |
|---|
| MNX_ID | MNXM342995 |
 |
| reference | slm:000450092 |
| formula | C15H24O19P3 |
| global charge | -5 |
| mol weight | 601.26 |
| InChIKey | IYIMUAGAVJMMPS-QWHOGKPRSA-I |
| InChI | InChI=1S/C15H29O19P3/c1-3-4-9(17)31-8(5-29-7(2)16)6-30-37(27,28)34-15-11(19)13(32-35(21,22)23)10(18)14(12(15)20)33-36(24,25)26/h8,10-15,18-20H,3-6H2,1-2H3,(H,27,28)(H2,21,22,23)(H2,24,25,26)/p-5/t8-,10-,11-,12-,13-,14+,15-/m1/s1 |
| SMILES | CCCC(=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](O)[C@H](OP(=O)([O-])[O-])[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C15H29O19P3/c1-3-4-9(17)31-8(5-29-7(2)16)6-30-37(27,28)34-15-11(19)13(32-35(21,22)23)10(18)14(12(15)20)33-36(24,25)26/h8,10-15,18-20H,3-6H2,1-2H3,(H,27,28)(H2,21,22,23)(H2,24,25,26)/t8-,10-,11-,12-,13-,14+,15-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][C:9](=[O:17])[O:31][C@H:8]([CH2:5][O:29][C:7]([CH3:2])=[O:16])[CH2:6][O:30][P:37]([OH:27])(=[O:28])[O:34][C@@H:15]1[C@H:11]([OH:19])[C@H:13]([O:32][P:35]([OH:21])([OH:22])=[O:23])[C@@H:10]([OH:18])[C@H:14]([O:33][P:36]([OH:24])([OH:25])=[O:26])[C@H:12]1[OH:20] |
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