| Properties | Image |
|---|
| MNX_ID | MNXM960603 |
 |
| reference | slm:000652988 |
| formula | C65H111NO9P |
| global charge | -1 |
| mol weight | 1081.575 |
| InChIKey | LJPSJJIFJWGEFE-SKQVHATQSA-M |
| InChI | InChI=1S/C65H112NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-32-33-35-37-39-41-43-45-48-51-54-57-65(69)75-62(61-74-76(70,71)73-59-58-66-63(67)55-52-49-46-15-12-9-6-3)60-72-64(68)56-53-50-47-44-42-40-38-36-34-27-25-23-21-19-17-14-11-8-5-2/h16-19,22-25,28-29,31-32,34,36,40,42,62H,4-15,20-21,26-27,30,33,35,37-39,41,43-61H2,1-3H3,(H,66,67)(H,70,71)/p-1/b18-16-,19-17-,24-22-,25-23-,29-28-,32-31-,36-34-,42-40-/t62-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C65H112NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-32-33-35-37-39-41-43-45-48-51-54-57-65(69)75-62(61-74-76(70,71)73-59-58-66-63(67)55-52-49-46-15-12-9-6-3)60-72-64(68)56-53-50-47-44-42-40-38-36-34-27-25-23-21-19-17-14-11-8-5-2/h16-19,22-25,28-29,31-32,34,36,40,42,62H,4-15,20-21,26-27,30,33,35,37-39,41,43-61H2,1-3H3,(H,66,67)(H,70,71)/b18-16-,19-17-,24-22-,25-23-,29-28-,32-31-,36-34-,42-40-/t62-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][C:65](=[O:69])[O:75][C@H:62]([CH2:60][O:72][C:64]([CH2:56][CH2:53][CH2:50][CH2:47][CH2:44]/[CH:42]=[CH:40]\[CH2:38]/[CH:36]=[CH:34]\[CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:68])[CH2:61][O:74][P:76]([OH:70])(=[O:71])[O:73][CH2:59][CH2:58][N:66]=[C:63]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:67] |
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