| Properties | Image |
|---|
| MNX_ID | MNXM1027000 |
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| reference | slm:000719389 |
| formula | C45H83NO8P |
| global charge | -1 |
| mol weight | 797.132 |
| InChIKey | HHCKLPODSZLJBF-CEEPCEGLSA-M |
| InChI | InChI=1S/C45H84NO8P/c1-4-7-10-13-15-17-19-21-22-23-24-26-28-31-33-36-44(47)46-38-40-52-55(49,50)53-42-43(54-45(48)37-34-30-12-9-6-3)41-51-39-35-32-29-27-25-20-18-16-14-11-8-5-2/h7,10,15,17,21-22,43H,4-6,8-9,11-14,16,18-20,23-42H2,1-3H3,(H,46,47)(H,49,50)/p-1/b10-7-,17-15-,22-21-/t43-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCCC)OC(=O)CCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C45H84NO8P/c1-4-7-10-13-15-17-19-21-22-23-24-26-28-31-33-36-44(47)46-38-40-52-55(49,50)53-42-43(54-45(48)37-34-30-12-9-6-3)41-51-39-35-32-29-27-25-20-18-16-14-11-8-5-2/h7,10,15,17,21-22,43H,4-6,8-9,11-14,16,18-20,23-42H2,1-3H3,(H,46,47)(H,49,50)/b10-7-,17-15-,22-21-/t43-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:22]\[CH2:23][CH2:24][CH2:26][CH2:28][CH2:31][CH2:33][CH2:36][C:44](=[N:46][CH2:38][CH2:40][O:52][P:55]([OH:49])(=[O:50])[O:53][CH2:42][C@@H:43]([CH2:41][O:51][CH2:39][CH2:35][CH2:32][CH2:29][CH2:27][CH2:25][CH2:20][CH2:18][CH2:16][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[O:54][C:45]([CH2:37][CH2:34][CH2:30][CH2:12][CH2:9][CH2:6][CH3:3])=[O:48])[OH:47] |
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