| Properties | Image |
MNX_ID | MNXM217548 |
 |
reference | slm:000037801 |
formula | C52H88O10P |
global charge | -1 |
mol weight | 904.24 |
InChIKey | CLCGKYGDBJBJBJ-MULBYFFDSA-M |
InChI | InChI=1S/C52H89O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-51(55)59-47-50(48-61-63(57,58)60-46-49(54)45-53)62-52(56)44-42-40-38-36-34-32-29-18-16-14-12-10-8-6-4-2/h11-14,17-19,21-22,24-25,29,34,36,49-50,53-54H,3-10,15-16,20,23,26-28,30-33,35,37-48H2,1-2H3,(H,57,58)/p-1/b13-11-,14-12-,19-17-,22-21-,25-24-,29-18-,36-34-/t49-,50+/m0/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
InChI (mnx) | InChI=1/C52H89O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-30-31-33-35-37-39-41-43-51(55)59-47-50(48-61-63(57,58)60-46-49(54)45-53)62-52(56)44-42-40-38-36-34-32-29-18-16-14-12-10-8-6-4-2/h11-14,17-19,21-22,24-25,29,34,36,49-50,53-54H,3-10,15-16,20,23,26-28,30-33,35,37-48H2,1-2H3,(H,57,58)/b13-11-,14-12-,19-17-,22-21-,25-24-,29-18-,36-34-/t49-,50+/m0/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:51](=[O:55])[O:59][CH2:47][C@H:50]([CH2:48][O:61][P:63]([OH:57])(=[O:58])[O:60][CH2:46][C@H:49]([CH2:45][OH:53])[OH:54])[O:62][C:52]([CH2:44][CH2:42][CH2:40][CH2:38]/[CH:36]=[CH:34]\[CH2:32]/[CH:29]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:56] |
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