| Properties | Image |
MNX_ID | MNXM327145 |
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reference | slm:000034568 |
formula | C41H76NO8P |
global charge | 0 |
mol weight | 742.032 |
InChIKey | RHTFGYQAXXIVLR-IUEYQMSOSA-N |
InChI | InChI=1S/C41H76NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,24,26,39H,3-10,12,14-16,18,20-23,25,27-38,42H2,1-2H3,(H,45,46)/b13-11-,19-17-,26-24-/t39-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCC/C=C\CCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C41H76NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,24,26,39H,3-10,12,14-16,18,20-23,25,27-38,42H2,1-2H3,(H,45,46)/b13-11-,19-17-,26-24-/t39-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][C:40](=[O:43])[O:47][CH2:37][C@H:39]([CH2:38][O:49][P:51]([OH:45])(=[O:46])[O:48][CH2:36][CH2:35][NH2:42])[O:50][C:41]([CH2:34][CH2:32][CH2:30][CH2:28]/[CH:26]=[CH:24]\[CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:44] |
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