| Properties | Image |
MNX_ID | MNXM71447 |
 |
reference | chebi:178294 |
formula | C36H70NO8P |
global charge | 0 |
mol weight | 675.929 |
InChIKey | CXDXDDHWBHPLKU-VCRWGMHCSA-N |
InChI | InChI=1S/C36H70NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-35(38)42-32-34(33-44-46(40,41)43-31-30-37)45-36(39)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h9,11,34H,3-8,10,12-33,37H2,1-2H3,(H,40,41)/b11-9-/t34-/m1/s1 |
SMILES | CCCC/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C36H70NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-35(38)42-32-34(33-44-46(40,41)43-31-30-37)45-36(39)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h9,11,34H,3-8,10,12-33,37H2,1-2H3,(H,40,41)/b11-9-/t34-/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7]/[CH:9]=[CH:11]\[CH2:13][CH2:15][CH2:17][CH2:19][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][C:35](=[O:38])[O:42][CH2:32][C@H:34]([CH2:33][O:44][P:46]([OH:40])(=[O:41])[O:43][CH2:31][CH2:30][NH2:37])[O:45][C:36]([CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:39] |
|