| Properties | Image |
|---|
| MNX_ID | MNXM961386 |
 |
| reference | slm:000653771 |
| formula | C59H97NO9P |
| global charge | -1 |
| mol weight | 995.397 |
| InChIKey | JFRFNUIVJGMVLG-HUNYCRPBSA-M |
| InChI | InChI=1S/C59H98NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-28-30-31-33-35-37-39-41-44-47-50-58(62)66-54-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-12-9-6-3)69-59(63)51-48-45-42-40-38-36-34-32-29-26-24-22-20-18-16-14-11-8-5-2/h8,11,15-18,21-24,27-29,31-33,36,38,56H,4-7,9-10,12-14,19-20,25-26,30,34-35,37,39-55H2,1-3H3,(H,60,61)(H,64,65)/p-1/b11-8-,17-15-,18-16-,23-21-,24-22-,28-27-,32-29-,33-31-,38-36-/t56-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C59H98NO9P/c1-4-7-10-13-15-17-19-21-23-25-27-28-30-31-33-35-37-39-41-44-47-50-58(62)66-54-56(55-68-70(64,65)67-53-52-60-57(61)49-46-43-12-9-6-3)69-59(63)51-48-45-42-40-38-36-34-32-29-26-24-22-20-18-16-14-11-8-5-2/h8,11,15-18,21-24,27-29,31-33,36,38,56H,4-7,9-10,12-14,19-20,25-26,30,34-35,37,39-55H2,1-3H3,(H,60,61)(H,64,65)/b11-8-,17-15-,18-16-,23-21-,24-22-,28-27-,32-29-,33-31-,38-36-/t56-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:25]/[CH:27]=[CH:28]\[CH2:30]/[CH:31]=[CH:33]\[CH2:35][CH2:37][CH2:39][CH2:41][CH2:44][CH2:47][CH2:50][C:58](=[O:62])[O:66][CH2:54][C@H:56]([CH2:55][O:68][P:70]([OH:64])(=[O:65])[O:67][CH2:53][CH2:52][N:60]=[C:57]([CH2:49][CH2:46][CH2:43][CH2:12][CH2:9][CH2:6][CH3:3])[OH:61])[O:69][C:59]([CH2:51][CH2:48][CH2:45][CH2:42][CH2:40]/[CH:38]=[CH:36]\[CH2:34]/[CH:32]=[CH:29]\[CH2:26]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:63] |
|