| Properties | Image |
MNX_ID | MNXM342486 |
 |
reference | slm:000025525 |
formula | C37H63O8P |
global charge | -2 |
mol weight | 666.877 |
InChIKey | MIJAQKFONIITBX-SWEIKDGHSA-L |
InChI | InChI=1S/C37H65O8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-37(39)45-36(33-43-35(2)38)34-44-46(40,41)42/h7-8,10-11,13-14,16-17,36H,3-6,9,12,15,18-34H2,1-2H3,(H2,40,41,42)/p-2/b8-7-,11-10-,14-13-,17-16-/t36-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])[O-] |
MNX internals
InChI (mnx) | InChI=1/C37H65O8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-37(39)45-36(33-43-35(2)38)34-44-46(40,41)42/h7-8,10-11,13-14,16-17,36H,3-6,9,12,15,18-34H2,1-2H3,(H2,40,41,42)/b8-7-,11-10-,14-13-,17-16-/t36-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][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][C:37](=[O:39])[O:45][C@H:36]([CH2:33][O:43][C:35]([CH3:2])=[O:38])[CH2:34][O:44][P:46]([OH:40])([OH:41])=[O:42] |
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