| Properties | Image |
MNX_ID | MNXM218006 |
 |
reference | slm:000002424 |
formula | C42H73NO10P |
global charge | -1 |
mol weight | 783.017 |
InChIKey | QFKJDLXZHUYSPZ-KBDYZBJOSA-M |
InChI | InChI=1S/C42H74NO10P/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-31-33-40(44)50-35-38(53-41(45)34-32-29-8-6-4-2)36-51-54(48,49)52-37-39(43)42(46)47/h10-11,13-14,16-17,19-20,38-39H,3-9,12,15,18,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/p-1/b11-10-,14-13-,17-16-,20-19-/t38-,39+/m1/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]([NH3+])C(=O)[O-])OC(=O)CCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C42H74NO10P/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-31-33-40(44)50-35-38(53-41(45)34-32-29-8-6-4-2)36-51-54(48,49)52-37-39(43)42(46)47/h10-11,13-14,16-17,19-20,38-39H,3-9,12,15,18,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/b11-10-,14-13-,17-16-,20-19-/t38-,39+/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:31][CH2:33][C:40](=[O:44])[O:50][CH2:35][C@H:38]([CH2:36][O:51][P:54]([OH:48])(=[O:49])[O:52][CH2:37][C@@H:39]([C:42](=[O:46])[OH:47])[NH2:43])[O:53][C:41]([CH2:34][CH2:32][CH2:29][CH2:8][CH2:6][CH2:4][CH3:2])=[O:45] |
|