| Properties | Image |
MNX_ID | MNXM192226 |
 |
reference | slm:000021076 |
formula | C33H61O8P |
global charge | -2 |
mol weight | 616.817 |
InChIKey | SDRDGSXLAKESOC-NKICYCNHSA-L |
InChI | InChI=1S/C33H63O8P/c1-3-5-7-9-11-13-14-15-16-17-18-20-21-23-25-27-32(34)39-29-31(30-40-42(36,37)38)41-33(35)28-26-24-22-19-12-10-8-6-4-2/h13-14,31H,3-12,15-30H2,1-2H3,(H2,36,37,38)/p-2/b14-13+/t31-/m1/s1 |
SMILES | CCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C33H63O8P/c1-3-5-7-9-11-13-14-15-16-17-18-20-21-23-25-27-32(34)39-29-31(30-40-42(36,37)38)41-33(35)28-26-24-22-19-12-10-8-6-4-2/h13-14,31H,3-12,15-30H2,1-2H3,(H2,36,37,38)/b14-13+/t31-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:14]/[CH2:15][CH2:16][CH2:17][CH2:18][CH2:20][CH2:21][CH2:23][CH2:25][CH2:27][C:32](=[O:34])[O:39][CH2:29][C@H:31]([CH2:30][O:40][P:42]([OH:36])([OH:37])=[O:38])[O:41][C:33]([CH2:28][CH2:26][CH2:24][CH2:22][CH2:19][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:35] |
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