| Properties | Image |
MNX_ID | MNXM193470 |
 |
reference | slm:000021192 |
formula | C59H97O8P |
global charge | -2 |
mol weight | 965.391 |
InChIKey | NNWWHBZBPNEKJO-ABKUUGPRSA-L |
InChI | InChI=1S/C59H99O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-29-30-32-34-36-38-40-42-44-46-48-50-52-54-59(61)67-57(56-66-68(62,63)64)55-65-58(60)53-51-49-47-45-43-41-39-37-35-33-31-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,23-26,28-29,33,35,57H,3-5,7,9-10,15-16,21-22,27,30-32,34,36-56H2,1-2H3,(H2,62,63,64)/p-2/b8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,29-28-,35-33-/t57-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
InChI (mnx) | InChI=1/C59H99O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-29-30-32-34-36-38-40-42-44-46-48-50-52-54-59(61)67-57(56-66-68(62,63)64)55-65-58(60)53-51-49-47-45-43-41-39-37-35-33-31-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,23-26,28-29,33,35,57H,3-5,7,9-10,15-16,21-22,27,30-32,34,36-56H2,1-2H3,(H2,62,63,64)/b8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,29-28-,35-33-/t57-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][C:59](=[O:61])[O:67][C@H:57]([CH2:55][O:65][C:58]([CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37]/[CH:35]=[CH:33]\[CH2:31]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:60])[CH2:56][O:66][P:68]([OH:62])([OH:63])=[O:64] |
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