| Properties | Image |
|---|
| MNX_ID | MNXM939070 |
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| reference | slm:000631455 |
| formula | C75H127NO9P |
| global charge | -1 |
| mol weight | 1217.813 |
| InChIKey | PSMUGPSWNFFRNV-AHXRKVLJSA-M |
| InChI | InChI=1S/C75H128NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-32-33-34-35-36-37-38-39-40-42-43-45-47-49-51-53-55-57-60-63-66-74(78)82-70-72(71-84-86(80,81)83-69-68-76-73(77)65-62-59-12-9-6-3)85-75(79)67-64-61-58-56-54-52-50-48-46-44-41-30-28-26-24-22-20-18-16-14-11-8-5-2/h7-8,10-11,15-18,21-24,27-30,32-33,44,46,72H,4-6,9,12-14,19-20,25-26,31,34-43,45,47-71H2,1-3H3,(H,76,77)(H,80,81)/p-1/b10-7-,11-8-,17-15-,18-16-,23-21-,24-22-,29-27-,30-28-,33-32-,46-44-/t72-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC |
MNX internals
| InChI (mnx) | InChI=1/C75H128NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-32-33-34-35-36-37-38-39-40-42-43-45-47-49-51-53-55-57-60-63-66-74(78)82-70-72(71-84-86(80,81)83-69-68-76-73(77)65-62-59-12-9-6-3)85-75(79)67-64-61-58-56-54-52-50-48-46-44-41-30-28-26-24-22-20-18-16-14-11-8-5-2/h7-8,10-11,15-18,21-24,27-30,32-33,44,46,72H,4-6,9,12-14,19-20,25-26,31,34-43,45,47-71H2,1-3H3,(H,76,77)(H,80,81)/b10-7-,11-8-,17-15-,18-16-,23-21-,24-22-,29-27-,30-28-,33-32-,46-44-/t72-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25]/[CH:27]=[CH:29]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:42][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][CH2:57][CH2:60][CH2:63][CH2:66][C:74](=[O:78])[O:82][CH2:70][C@H:72]([CH2:71][O:84][P:86]([OH:80])(=[O:81])[O:83][CH2:69][CH2:68][N:76]=[C:73]([CH2:65][CH2:62][CH2:59][CH2:12][CH2:9][CH2:6][CH3:3])[OH:77])[O:85][C:75]([CH2:67][CH2:64][CH2:61][CH2:58][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48]/[CH:46]=[CH:44]\[CH2:41]/[CH:30]=[CH:28]\[CH2:26]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:79] |
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