| Properties | Image |
|---|
| MNX_ID | MNXM179950 |
 |
| reference | slm:000426126 |
| formula | C73H116O19P3 |
| global charge | -5 |
| mol weight | 1390.634 |
| InChIKey | YFJSMVSYXBHXGZ-GJDCPXAJSA-I |
| InChI | InChI=1S/C73H121O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-58-60-62-67(75)89-65(64-88-95(85,86)92-71-68(76)69(77)72(90-93(79,80)81)73(70(71)78)91-94(82,83)84)63-87-66(74)61-59-57-55-53-51-49-47-45-43-41-39-37-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-30,32-33,37,39,43,45,65,68-73,76-78H,3-4,9-10,15-16,21-22,27-28,31,34-36,38,40-42,44,46-64H2,1-2H3,(H,85,86)(H2,79,80,81)(H2,82,83,84)/p-5/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,33-32-,39-37-,45-43-/t65-,68-,69-,70+,71+,72+,73+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)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/C73H121O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-58-60-62-67(75)89-65(64-88-95(85,86)92-71-68(76)69(77)72(90-93(79,80)81)73(70(71)78)91-94(82,83)84)63-87-66(74)61-59-57-55-53-51-49-47-45-43-41-39-37-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-30,32-33,37,39,43,45,65,68-73,76-78H,3-4,9-10,15-16,21-22,27-28,31,34-36,38,40-42,44,46-64H2,1-2H3,(H,85,86)(H2,79,80,81)(H2,82,83,84)/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,33-32-,39-37-,45-43-/t65-,68-,69-,70+,71+,72+,73+/m1/s1 |
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| 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]/[CH:32]=[CH:33]\[CH2:34][CH2:35][CH2:36][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][C:67](=[O:75])[O:89][C@H:65]([CH2:63][O:87][C:66]([CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47]/[CH:45]=[CH:43]\[CH2:41]/[CH:39]=[CH:37]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:74])[CH2:64][O:88][P:95]([OH:85])(=[O:86])[O:92][C@H:71]1[C@H:68]([OH:76])[C@@H:69]([OH:77])[C@H:72]([O:90][P:93]([OH:79])([OH:80])=[O:81])[C@@H:73]([O:91][P:94]([OH:82])([OH:83])=[O:84])[C@H:70]1[OH:78] |
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