| Properties | Image |
|---|
| MNX_ID | MNXM342595 |
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| reference | slm:000005437 |
| formula | C44H75NO10P |
| global charge | -1 |
| mol weight | 809.055 |
| InChIKey | CUAVSLLPEGHNPM-ASCHRBPMSA-M |
| InChI | InChI=1S/C44H76NO10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-43(47)55-41(37-52-40(2)46)38-53-56(50,51)54-39-42(45)44(48)49/h4-5,7-8,10-11,13-14,16-17,41-42H,3,6,9,12,15,18-39,45H2,1-2H3,(H,48,49)(H,50,51)/p-1/b5-4-,8-7-,11-10-,14-13-,17-16-/t41-,42+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C44H76NO10P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-43(47)55-41(37-52-40(2)46)38-53-56(50,51)54-39-42(45)44(48)49/h4-5,7-8,10-11,13-14,16-17,41-42H,3,6,9,12,15,18-39,45H2,1-2H3,(H,48,49)(H,50,51)/b5-4-,8-7-,11-10-,14-13-,17-16-/t41-,42+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:4]=[CH:5]\[CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][C:43](=[O:47])[O:55][C@H:41]([CH2:37][O:52][C:40]([CH3:2])=[O:46])[CH2:38][O:53][P:56]([OH:50])(=[O:51])[O:54][CH2:39][C@@H:42]([C:44](=[O:48])[OH:49])[NH2:45] |
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