| Properties | Image |
|---|
| MNX_ID | MNXM181183 |
 |
| reference | slm:000020885 |
| formula | C67H111O8P |
| global charge | -2 |
| mol weight | 1075.591 |
| InChIKey | VEZMLXGISLFASJ-LQMLQZFUSA-L |
| InChI | InChI=1S/C67H113O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-58-60-62-67(69)75-65(64-74-76(70,71)72)63-73-66(68)61-59-57-55-53-51-49-47-45-43-41-39-37-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-30,37,39,43,45,65H,3-4,6,8-10,15-16,21-22,27-28,31-36,38,40-42,44,46-64H2,1-2H3,(H2,70,71,72)/p-2/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,39-37-,45-43-/t65-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C67H113O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-58-60-62-67(69)75-65(64-74-76(70,71)72)63-73-66(68)61-59-57-55-53-51-49-47-45-43-41-39-37-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-30,37,39,43,45,65H,3-4,6,8-10,15-16,21-22,27-28,31-36,38,40-42,44,46-64H2,1-2H3,(H2,70,71,72)/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,30-29-,39-37-,45-43-/t65-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:30]\[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][CH2:60][CH2:62][C:67](=[O:69])[O:75][C@H:65]([CH2:63][O:73][C:66]([CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47]/[CH:45]=[CH:43]\[CH2:41]/[CH:39]=[CH:37]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:68])[CH2:64][O:74][P:76]([OH:70])([OH:71])=[O:72] |
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