| Properties | Image |
|---|
| MNX_ID | MNXM303011 |
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| reference | slm:000018074 |
| formula | C41H70O13P |
| global charge | -1 |
| mol weight | 801.972 |
| InChIKey | MPVQYRZJVAFUMY-RQCQIHCOSA-M |
| InChI | InChI=1S/C41H71O13P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-23-25-27-29-34(42)51-31-33(53-35(43)30-28-26-24-21-12-10-8-6-4-2)32-52-55(49,50)54-41-39(47)37(45)36(44)38(46)40(41)48/h5,7,11,13,15-16,18-19,33,36-41,44-48H,3-4,6,8-10,12,14,17,20-32H2,1-2H3,(H,49,50)/p-1/b7-5-,13-11-,16-15-,19-18-/t33-,36-,37-,38+,39-,40-,41-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=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(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C41H71O13P/c1-3-5-7-9-11-13-14-15-16-17-18-19-20-22-23-25-27-29-34(42)51-31-33(53-35(43)30-28-26-24-21-12-10-8-6-4-2)32-52-55(49,50)54-41-39(47)37(45)36(44)38(46)40(41)48/h5,7,11,13,15-16,18-19,33,36-41,44-48H,3-4,6,8-10,12,14,17,20-32H2,1-2H3,(H,49,50)/b7-5-,13-11-,16-15-,19-18-/t33-,36-,37-,38+,39-,40-,41-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20][CH2:22][CH2:23][CH2:25][CH2:27][CH2:29][C:34](=[O:42])[O:51][CH2:31][C@H:33]([CH2:32][O:52][P:55]([OH:49])(=[O:50])[O:54][C@@H:41]1[C@H:39]([OH:47])[C@H:37]([OH:45])[C@@H:36]([OH:44])[C@H:38]([OH:46])[C@H:40]1[OH:48])[O:53][C:35]([CH2:30][CH2:28][CH2:26][CH2:24][CH2:21][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:43] |
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