| Properties | Image |
|---|
| MNX_ID | MNXM223696 |
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| reference | slm:000037972 |
| formula | C44H80O10P |
| global charge | -1 |
| mol weight | 800.088 |
| InChIKey | KMDNUQGTKIZHME-DGZTYHAWSA-M |
| InChI | InChI=1S/C44H81O10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-35-43(47)51-39-42(40-53-55(49,50)52-38-41(46)37-45)54-44(48)36-34-32-30-28-26-23-16-14-12-10-8-6-4-2/h8,10,14,16-18,41-42,45-46H,3-7,9,11-13,15,19-40H2,1-2H3,(H,49,50)/p-1/b10-8-,16-14-,18-17-/t41-,42+/m0/s1 |
| SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OC[C@@H](O)CO |
MNX internals
| InChI (mnx) | InChI=1/C44H81O10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-35-43(47)51-39-42(40-53-55(49,50)52-38-41(46)37-45)54-44(48)36-34-32-30-28-26-23-16-14-12-10-8-6-4-2/h8,10,14,16-18,41-42,45-46H,3-7,9,11-13,15,19-40H2,1-2H3,(H,49,50)/b10-8-,16-14-,18-17-/t41-,42+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:18]\[CH2:19][CH2:20][CH2:21][CH2:22][CH2:24][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][C:43](=[O:47])[O:51][CH2:39][C@H:42]([CH2:40][O:53][P:55]([OH:49])(=[O:50])[O:52][CH2:38][C@H:41]([CH2:37][OH:45])[OH:46])[O:54][C:44]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:23]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH2:4][CH3:2])=[O:48] |
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