| Properties | Image |
|---|
| MNX_ID | MNXM321591 |
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| reference | slm:000040840 |
| formula | C54H100O10P |
| global charge | -1 |
| mol weight | 940.358 |
| InChIKey | JDUPGAKUBNMRBC-ABEJOYJXSA-M |
| InChI | InChI=1S/C54H101O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-54(58)64-52(50-63-65(59,60)62-48-51(56)47-55)49-61-53(57)45-43-41-39-37-35-33-31-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,31,51-52,55-56H,3-5,7,9-11,13,15-17,19-30,32-50H2,1-2H3,(H,59,60)/p-1/b8-6-,14-12-,31-18-/t51-,52+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H101O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-54(58)64-52(50-63-65(59,60)62-48-51(56)47-55)49-61-53(57)45-43-41-39-37-35-33-31-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,31,51-52,55-56H,3-5,7,9-11,13,15-17,19-30,32-50H2,1-2H3,(H,59,60)/b8-6-,14-12-,31-18-/t51-,52+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:54](=[O:58])[O:64][C@H:52]([CH2:49][O:61][C:53]([CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33]/[CH:31]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:57])[CH2:50][O:63][P:65]([OH:59])(=[O:60])[O:62][CH2:48][C@H:51]([CH2:47][OH:55])[OH:56] |
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