| Properties | Image |
|---|
| MNX_ID | MNXM236473 |
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| reference | slm:000126148 |
| formula | C46H88O5 |
| global charge | 0 |
| mol weight | 721.205 |
| InChIKey | PQYVWILVJDFOMO-FSLNXMMISA-N |
| InChI | InChI=1S/C46H88O5/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-27-28-30-32-34-36-38-40-45(48)50-43-44(42-47)51-46(49)41-39-37-35-33-31-29-26-20-18-16-14-12-10-8-6-4-2/h17,19,44,47H,3-16,18,20-43H2,1-2H3/b19-17-/t44-/m0/s1 |
| SMILES | CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C46H88O5/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-27-28-30-32-34-36-38-40-45(48)50-43-44(42-47)51-46(49)41-39-37-35-33-31-29-26-20-18-16-14-12-10-8-6-4-2/h17,19,44,47H,3-16,18,20-43H2,1-2H3/b19-17-/t44-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:27][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][C:45](=[O:48])[O:50][CH2:43][C@H:44]([CH2:42][OH:47])[O:51][C:46]([CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:26][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:49] |
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