| Properties | Image |
|---|
| MNX_ID | MNXM181117 |
 |
| reference | slm:000438999 |
| formula | C73H117O22P4 |
| global charge | -7 |
| mol weight | 1470.613 |
| InChIKey | XUIDVPQICPQXQR-STVKMTPQSA-G |
| InChI | InChI=1S/C73H124O22P4/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)91-65(64-90-99(87,88)95-70-68(76)71(92-96(78,79)80)73(94-98(84,85)86)72(69(70)77)93-97(81,82)83)63-89-66(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/h5,7,11-14,17-20,23-26,29-30,32-33,37,39,43,45,65,68-73,76-77H,3-4,6,8-10,15-16,21-22,27-28,31,34-36,38,40-42,44,46-64H2,1-2H3,(H,87,88)(H2,78,79,80)(H2,81,82,83)(H2,84,85,86)/p-7/b7-5-,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\CCCCC)COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C73H124O22P4/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)91-65(64-90-99(87,88)95-70-68(76)71(92-96(78,79)80)73(94-98(84,85)86)72(69(70)77)93-97(81,82)83)63-89-66(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/h5,7,11-14,17-20,23-26,29-30,32-33,37,39,43,45,65,68-73,76-77H,3-4,6,8-10,15-16,21-22,27-28,31,34-36,38,40-42,44,46-64H2,1-2H3,(H,87,88)(H2,78,79,80)(H2,81,82,83)(H2,84,85,86)/b7-5-,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 (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:91][C@H:65]([CH2:63][O:89][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][CH2:8][CH2:6][CH2:4][CH3:2])=[O:74])[CH2:64][O:90][P:99]([OH:87])(=[O:88])[O:95][C@@H:70]1[C@H:68]([OH:76])[C@H:71]([O:92][P:96]([OH:78])([OH:79])=[O:80])[C@@H:73]([O:94][P:98]([OH:84])([OH:85])=[O:86])[C@H:72]([O:93][P:97]([OH:81])([OH:82])=[O:83])[C@H:69]1[OH:77] |
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