| Properties | Image |
|---|
| MNX_ID | MNXM217981 |
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| reference | slm:000022033 |
| formula | C49H87O8P |
| global charge | -2 |
| mol weight | 835.201 |
| InChIKey | YRPUNYLQUQATPN-DUSIESGVSA-L |
| InChI | InChI=1S/C49H89O8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-48(50)55-45-47(46-56-58(52,53)54)57-49(51)44-42-40-38-36-34-32-29-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,47H,3-10,12,14-16,18,20,23,26-46H2,1-2H3,(H2,52,53,54)/p-2/b13-11-,19-17-,22-21-,25-24-/t47-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C49H89O8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-48(50)55-45-47(46-56-58(52,53)54)57-49(51)44-42-40-38-36-34-32-29-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,47H,3-10,12,14-16,18,20,23,26-46H2,1-2H3,(H2,52,53,54)/b13-11-,19-17-,22-21-,25-24-/t47-/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]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26][CH2:27][CH2:28][CH2:30][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][C:48](=[O:50])[O:55][CH2:45][C@H:47]([CH2:46][O:56][P:58]([OH:52])([OH:53])=[O:54])[O:57][C:49]([CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:29][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:51] |
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