| Properties | Image |
|---|
| MNX_ID | MNXM337692 |
 |
| reference | slm:000018860 |
| formula | C25H44O13P |
| global charge | -1 |
| mol weight | 583.588 |
| InChIKey | KMDUGWNFPPYMJI-LWTJYNJSSA-M |
| InChI | InChI=1S/C25H45O13P/c1-3-4-5-6-7-8-9-10-11-12-13-14-19(27)35-15-18(37-17(2)26)16-36-39(33,34)38-25-23(31)21(29)20(28)22(30)24(25)32/h6-7,18,20-25,28-32H,3-5,8-16H2,1-2H3,(H,33,34)/p-1/b7-6-/t18-,20-,21-,22+,23-,24-,25-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O)OC(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C25H45O13P/c1-3-4-5-6-7-8-9-10-11-12-13-14-19(27)35-15-18(37-17(2)26)16-36-39(33,34)38-25-23(31)21(29)20(28)22(30)24(25)32/h6-7,18,20-25,28-32H,3-5,8-16H2,1-2H3,(H,33,34)/b7-6-/t18-,20-,21-,22+,23-,24-,25-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5]/[CH:6]=[CH:7]\[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][C:19](=[O:27])[O:35][CH2:15][C@H:18]([CH2:16][O:36][P:39]([OH:33])(=[O:34])[O:38][C@@H:25]1[C@H:23]([OH:31])[C@H:21]([OH:29])[C@@H:20]([OH:28])[C@H:22]([OH:30])[C@H:24]1[OH:32])[O:37][C:17]([CH3:2])=[O:26] |
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