| Properties | Image |
MNX_ID | MNXM332214 |
 |
reference | slm:000012268 |
formula | C39H76NO8P |
global charge | 0 |
mol weight | 718.01 |
InChIKey | ICFSWSCEXHKCFO-MWQHCWNRSA-N |
InChI | InChI=1S/C39H76NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-38(41)45-34-37(35-47-49(43,44)46-33-32-40(4,5)6)48-39(42)31-28-25-22-19-20-23-26-29-36(2)3/h14-15,36-37H,7-13,16-35H2,1-6H3/b15-14-/t37-/m1/s1 |
SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCC(C)C |
MNX internals
InChI (mnx) | InChI=1/C39H76NO8P/c1-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-38(41)45-34-37(35-47-49(43,44)46-33-32-40(4,5)6)48-39(42)31-28-25-22-19-20-23-26-29-36(2)3/h14-15,36-37H,7-13,16-35H2,1-6H3/b15-14-/t37-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]/[CH:14]=[CH:15]\[CH2:16][CH2:17][CH2:18][CH2:21][CH2:24][CH2:27][CH2:30][C:38](=[O:41])[O:45][CH2:34][C@H:37]([CH2:35][O:47][P:49](=[O:43])([O-:44])[O:46][CH2:33][CH2:32][N+:40]([CH3:4])([CH3:5])[CH3:6])[O:48][C:39]([CH2:31][CH2:28][CH2:25][CH2:22][CH2:19][CH2:20][CH2:23][CH2:26][CH2:29][CH:36]([CH3:2])[CH3:3])=[O:42] |
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