| Properties | Image |
MNX_ID | MNXM90510 |
 |
reference | biggM:pa161 |
formula | C35H64O8P |
global charge | -1 |
mol weight | 643.863 |
InChIKey | YLDMPBGXNLGSQO-UHFFFAOYSA-M |
InChI | InChI=1S/C35H65O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(36)41-31-33(32-42-44(38,39)40)43-35(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,33H,3-12,17-32H2,1-2H3,(H2,38,39,40)/p-1 |
SMILES | CCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)([O-])O)OC(=O)CCCCCCCC=CCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C35H65O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(36)41-31-33(32-42-44(38,39)40)43-35(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,33H,3-12,17-32H2,1-2H3,(H2,38,39,40)/b15-13?,16-14?/t33? |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH:13]=[CH:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][C:34](=[O:36])[O:41][CH2:31][CH:33]([CH2:32][O:42][P:44]([OH:38])([OH:39])=[O:40])[O:43][C:35]([CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH:16]=[CH:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:37] |
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