| Properties | Image |
|---|
| MNX_ID | MNXM834572 |
 |
| reference | slm:000524384 |
| formula | C91H146O17P2 |
| global charge | -2 |
| mol weight | 1574.1 |
| InChIKey | SAMFDEAYAPRYNA-RIVKWCJTSA-L |
| InChI | InChI=1S/C91H148O17P2/c1-5-9-13-17-21-25-29-33-37-40-42-45-48-52-56-60-64-68-72-76-89(94)102-82-87(107-90(95)77-73-69-65-61-57-53-49-44-39-35-31-27-23-19-15-11-7-3)84-106-110(99,100)104-80-85(92)79-103-109(97,98)105-83-86(81-101-88(93)75-71-67-63-59-55-51-47-36-32-28-24-20-16-12-8-4)108-91(96)78-74-70-66-62-58-54-50-46-43-41-38-34-30-26-22-18-14-10-6-2/h11,15,21-23,25-27,33-35,37-39,42-43,45-46,49,52-54,56,58,61,64-66,68,70,85-87,92H,5-10,12-14,16-20,24,28-32,36,40-41,44,47-48,50-51,55,57,59-60,62-63,67,69,71-84H2,1-4H3,(H,97,98)(H,99,100)/p-2/b15-11-,25-21-,26-22-,27-23-,37-33-,38-34-,39-35-,45-42-,46-43-,53-49-,56-52-,58-54-,65-61-,68-64-,70-66-/t85?,86-,87-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCC(O)COP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C91H148O17P2/c1-5-9-13-17-21-25-29-33-37-40-42-45-48-52-56-60-64-68-72-76-89(94)102-82-87(107-90(95)77-73-69-65-61-57-53-49-44-39-35-31-27-23-19-15-11-7-3)84-106-110(99,100)104-80-85(92)79-103-109(97,98)105-83-86(81-101-88(93)75-71-67-63-59-55-51-47-36-32-28-24-20-16-12-8-4)108-91(96)78-74-70-66-62-58-54-50-46-43-41-38-34-30-26-22-18-14-10-6-2/h11,15,21-23,25-27,33-35,37-39,42-43,45-46,49,52-54,56,58,61,64-66,68,70,85-87,92H,5-10,12-14,16-20,24,28-32,36,40-41,44,47-48,50-51,55,57,59-60,62-63,67,69,71-84H2,1-4H3,(H,97,98)(H,99,100)/b15-11-,25-21-,26-22-,27-23-,37-33-,38-34-,39-35-,45-42-,46-43-,53-49-,56-52-,58-54-,65-61-,68-64-,70-66-/t85?,86-,87-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:9][CH2:13][CH2:17]/[CH:21]=[CH:25]\[CH2:29]/[CH:33]=[CH:37]\[CH2:40]/[CH:42]=[CH:45]\[CH2:48]/[CH:52]=[CH:56]\[CH2:60]/[CH:64]=[CH:68]\[CH2:72][CH2:76][C:89](=[O:94])[O:102][CH2:82][C@H:87]([CH2:84][O:106][P:110]([OH:99])(=[O:100])[O:104][CH2:80][CH:85]([CH2:79][O:103][P:109]([OH:97])(=[O:98])[O:105][CH2:83][C@@H:86]([CH2:81][O:101][C:88]([CH2:75][CH2:71][CH2:67][CH2:63][CH2:59][CH2:55][CH2:51][CH2:47][CH2:36][CH2:32][CH2:28][CH2:24][CH2:20][CH2:16][CH2:12][CH2:8][CH3:4])=[O:93])[O:108][C:91]([CH2:78][CH2:74]/[CH:70]=[CH:66]\[CH2:62]/[CH:58]=[CH:54]\[CH2:50]/[CH:46]=[CH:43]\[CH2:41]/[CH:38]=[CH:34]\[CH2:30]/[CH:26]=[CH:22]\[CH2:18][CH2:14][CH2:10][CH2:6][CH3:2])=[O:96])[OH:92])[O:107][C:90]([CH2:77][CH2:73][CH2:69]/[CH:65]=[CH:61]\[CH2:57]/[CH:53]=[CH:49]\[CH2:44]/[CH:39]=[CH:35]\[CH2:31]/[CH:27]=[CH:23]\[CH2:19]/[CH:15]=[CH:11]\[CH2:7][CH3:3])=[O:95] |
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