| Properties | Image |
|---|
| MNX_ID | MNXM217429 |
 |
| reference | slm:000465705 |
| formula | C75H126O19P3 |
| global charge | -5 |
| mol weight | 1424.736 |
| InChIKey | WFRHQKIRABDMQL-YHHOZFKGSA-I |
| InChI | InChI=1S/C75H131O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-54-56-58-60-62-64-69(77)91-67(66-90-97(87,88)94-73-70(78)71(79)74(92-95(81,82)83)75(72(73)80)93-96(84,85)86)65-89-68(76)63-61-59-57-55-53-51-49-47-45-43-41-39-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-30,39,41,67,70-75,78-80H,3-4,6,8-10,15-16,21-22,27-28,31-38,40,42-66H2,1-2H3,(H,87,88)(H2,81,82,83)(H2,84,85,86)/p-5/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,41-39-/t67-,70-,71+,72+,73-,74-,75-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C75H131O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-54-56-58-60-62-64-69(77)91-67(66-90-97(87,88)94-73-70(78)71(79)74(92-95(81,82)83)75(72(73)80)93-96(84,85)86)65-89-68(76)63-61-59-57-55-53-51-49-47-45-43-41-39-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-30,39,41,67,70-75,78-80H,3-4,6,8-10,15-16,21-22,27-28,31-38,40,42-66H2,1-2H3,(H,87,88)(H2,81,82,83)(H2,84,85,86)/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,41-39-/t67-,70-,71+,72+,73-,74-,75-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:30]\[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][CH2:60][CH2:62][CH2:64][C:69](=[O:77])[O:91][C@H:67]([CH2:65][O:89][C:68]([CH2:63][CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43]/[CH:41]=[CH:39]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:76])[CH2:66][O:90][P:97]([OH:87])(=[O:88])[O:94][C@@H:73]1[C@H:70]([OH:78])[C@H:71]([OH:79])[C@@H:74]([O:92][P:95]([OH:81])([OH:82])=[O:83])[C@H:75]([O:93][P:96]([OH:84])([OH:85])=[O:86])[C@H:72]1[OH:80] |
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