| Properties | Image |
|---|
| MNX_ID | MNXM344236 |
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| reference | slm:000443773 |
| formula | C15H23O22P4 |
| global charge | -7 |
| mol weight | 679.223 |
| InChIKey | KCKBCIKKRJJNJT-QFBFJEEOSA-G |
| InChI | InChI=1S/C15H30O22P4/c1-3-4-9(17)31-5-8(33-7(2)16)6-32-41(29,30)37-12-10(18)13(34-38(20,21)22)15(36-40(26,27)28)14(11(12)19)35-39(23,24)25/h8,10-15,18-19H,3-6H2,1-2H3,(H,29,30)(H2,20,21,22)(H2,23,24,25)(H2,26,27,28)/p-7/t8-,10+,11+,12-,13+,14-,15-/m1/s1 |
| SMILES | CCCC(=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(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C15H30O22P4/c1-3-4-9(17)31-5-8(33-7(2)16)6-32-41(29,30)37-12-10(18)13(34-38(20,21)22)15(36-40(26,27)28)14(11(12)19)35-39(23,24)25/h8,10-15,18-19H,3-6H2,1-2H3,(H,29,30)(H2,20,21,22)(H2,23,24,25)(H2,26,27,28)/t8-,10+,11+,12-,13+,14-,15-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][C:9](=[O:17])[O:31][CH2:5][C@H:8]([CH2:6][O:32][P:41]([OH:29])(=[O:30])[O:37][C@@H:12]1[C@H:10]([OH:18])[C@H:13]([O:34][P:38]([OH:20])([OH:21])=[O:22])[C@@H:15]([O:36][P:40]([OH:26])([OH:27])=[O:28])[C@H:14]([O:35][P:39]([OH:23])([OH:24])=[O:25])[C@H:11]1[OH:19])[O:33][C:7]([CH3:2])=[O:16] |
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