| Properties | Image |
MNX_ID | MNXM343911 |
 |
reference | slm:000025613 |
formula | C27H41O8P |
global charge | -2 |
mol weight | 524.591 |
InChIKey | MXBGPIQHQSSEIY-OIGCMQTBSA-L |
InChI | InChI=1S/C27H43O8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-27(29)35-25(24-34-36(30,31)32)23-33-26(28)21-4-2/h5-6,8-9,11-12,14-15,17-18,25H,3-4,7,10,13,16,19-24H2,1-2H3,(H2,30,31,32)/p-2/b6-5-,9-8-,12-11-,15-14-,18-17-/t25-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])[O-] |
MNX internals
InChI (mnx) | InChI=1/C27H43O8P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-27(29)35-25(24-34-36(30,31)32)23-33-26(28)21-4-2/h5-6,8-9,11-12,14-15,17-18,25H,3-4,7,10,13,16,19-24H2,1-2H3,(H2,30,31,32)/b6-5-,9-8-,12-11-,15-14-,18-17-/t25-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:20][CH2:22][C:27](=[O:29])[O:35][C@H:25]([CH2:23][O:33][C:26]([CH2:21][CH2:4][CH3:2])=[O:28])[CH2:24][O:34][P:36]([OH:30])([OH:31])=[O:32] |
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