| Properties | Image |
|---|
| MNX_ID | MNXM342614 |
 |
| reference | slm:000475660 |
| formula | C46H79O13P2 |
| global charge | -3 |
| mol weight | 902.073 |
| InChIKey | SIZCCFQLRXEWBT-UWWRACBUSA-K |
| InChI | InChI=1S/C46H82O13P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-46(49)59-45(41-55-43(2)47)42-58-61(53,54)57-40-44(48)39-56-60(50,51)52/h4-5,7-8,10-11,13-14,16-17,44-45,48H,3,6,9,12,15,18-42H2,1-2H3,(H,53,54)(H2,50,51,52)/p-3/b5-4-,8-7-,11-10-,14-13-,17-16-/t44-,45+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C46H82O13P2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-46(49)59-45(41-55-43(2)47)42-58-61(53,54)57-40-44(48)39-56-60(50,51)52/h4-5,7-8,10-11,13-14,16-17,44-45,48H,3,6,9,12,15,18-42H2,1-2H3,(H,53,54)(H2,50,51,52)/b5-4-,8-7-,11-10-,14-13-,17-16-/t44-,45+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:4]=[CH:5]\[CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][C:46](=[O:49])[O:59][C@H:45]([CH2:41][O:55][C:43]([CH3:2])=[O:47])[CH2:42][O:58][P:61]([OH:53])(=[O:54])[O:57][CH2:40][C@H:44]([CH2:39][O:56][P:60]([OH:50])([OH:51])=[O:52])[OH:48] |
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