| Properties | Image |
|---|
| MNX_ID | MNXM199273 |
 |
| reference | slm:000042976 |
| formula | C29H50O12P |
| global charge | -1 |
| mol weight | 621.681 |
| InChIKey | BNXYBNVTWAMAER-ZDGZNQOKSA-M |
| InChI | InChI=1S/C29H51O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(31)39-20-22(30)21-40-42(37,38)41-29-27(35)25(33)24(32)26(34)28(29)36/h3-4,6-7,9-10,22,24-30,32-36H,2,5,8,11-21H2,1H3,(H,37,38)/p-1/b4-3-,7-6-,10-9-/t22-,24-,25-,26+,27-,28-,29-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=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/C29H51O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(31)39-20-22(30)21-40-42(37,38)41-29-27(35)25(33)24(32)26(34)28(29)36/h3-4,6-7,9-10,22,24-30,32-36H,2,5,8,11-21H2,1H3,(H,37,38)/b4-3-,7-6-,10-9-/t22-,24-,25-,26+,27-,28-,29-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:2]/[CH:3]=[CH:4]\[CH2:5]/[CH:6]=[CH:7]\[CH2:8]/[CH:9]=[CH:10]\[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][C:23](=[O:31])[O:39][CH2:20][C@H:22]([CH2:21][O:40][P:42]([OH:37])(=[O:38])[O:41][C@@H:29]1[C@H:27]([OH:35])[C@H:25]([OH:33])[C@@H:24]([OH:32])[C@H:26]([OH:34])[C@H:28]1[OH:36])[OH:30] |
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