| Properties | Image |
|---|
| MNX_ID | MNXM938588 |
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| reference | slm:000630973 |
| formula | C72H127NO9P |
| global charge | -1 |
| mol weight | 1181.78 |
| InChIKey | KMBPNDXLCHFWDA-ONVRFIEYSA-M |
| InChI | InChI=1S/C72H128NO9P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-46-50-54-58-62-71(75)79-66-69(82-72(76)63-59-55-51-47-43-44-48-52-56-60-68(3)4)67-81-83(77,78)80-65-64-73-70(74)61-57-53-49-45-41-39-37-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-21,23-24,26-27,37,68-69H,5-6,8,10-12,17-18,22,25,28-36,38-67H2,1-4H3,(H,73,74)(H,77,78)/p-1/b9-7-,15-13-,16-14-,21-19-,24-23-,27-26-,37-20-/t69-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C72H128NO9P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-46-50-54-58-62-71(75)79-66-69(82-72(76)63-59-55-51-47-43-44-48-52-56-60-68(3)4)67-81-83(77,78)80-65-64-73-70(74)61-57-53-49-45-41-39-37-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-21,23-24,26-27,37,68-69H,5-6,8,10-12,17-18,22,25,28-36,38-67H2,1-4H3,(H,73,74)(H,77,78)/b9-7-,15-13-,16-14-,21-19-,24-23-,27-26-,37-20-/t69-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:46][CH2:50][CH2:54][CH2:58][CH2:62][C:71](=[O:75])[O:79][CH2:66][C@H:69]([CH2:67][O:81][P:83]([OH:77])(=[O:78])[O:80][CH2:65][CH2:64][N:73]=[C:70]([CH2:61][CH2:57][CH2:53][CH2:49][CH2:45][CH2:41][CH2:39]/[CH:37]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:74])[O:82][C:72]([CH2:63][CH2:59][CH2:55][CH2:51][CH2:47][CH2:43][CH2:44][CH2:48][CH2:52][CH2:56][CH2:60][CH:68]([CH3:3])[CH3:4])=[O:76] |
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