| Properties | Image |
|---|
| MNX_ID | MNXM185636 |
 |
| reference | slm:000042971 |
| formula | C31H54O12P |
| global charge | -1 |
| mol weight | 649.735 |
| InChIKey | CWJJECLSZQDEPA-CWTSLKLTSA-M |
| InChI | InChI=1S/C31H55O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(33)41-22-24(32)23-42-44(39,40)43-31-29(37)27(35)26(34)28(36)30(31)38/h6-7,9-10,12-13,24,26-32,34-38H,2-5,8,11,14-23H2,1H3,(H,39,40)/p-1/b7-6-,10-9-,13-12-/t24-,26-,27-,28+,29-,30-,31-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C31H55O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(33)41-22-24(32)23-42-44(39,40)43-31-29(37)27(35)26(34)28(36)30(31)38/h6-7,9-10,12-13,24,26-32,34-38H,2-5,8,11,14-23H2,1H3,(H,39,40)/b7-6-,10-9-,13-12-/t24-,26-,27-,28+,29-,30-,31-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5]/[CH:6]=[CH:7]\[CH2:8]/[CH:9]=[CH:10]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][C:25](=[O:33])[O:41][CH2:22][C@H:24]([CH2:23][O:42][P:44]([OH:39])(=[O:40])[O:43][C@@H:31]1[C@H:29]([OH:37])[C@H:27]([OH:35])[C@@H:26]([OH:34])[C@H:28]([OH:36])[C@H:30]1[OH:38])[OH:32] |
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