| Properties | Image |
|---|
| MNX_ID | MNXM1191297 |
 |
| reference | envipathM:...f20626990ff6 |
| formula | C54H98O11 |
| global charge | 0 |
| mol weight | 923.367 |
| InChIKey | JQZUYOHCMSCDRM-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H98O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-26-34-41-54(61)64-45(43-62-52(59)39-32-27-21-24-30-36-47(56)46(55)35-29-23-11-8-5-2)44-63-53(60)40-33-28-22-25-31-37-48(57)49(58)42-51-50(65-51)38-9-6-3/h23,29,45,47-51,56-58H,4-22,24-28,30-44H2,1-3H3 |
| SMILES | CCCCC=CCC(=O)C(O)CCCCCCCC(=O)OCC(COC(=O)CCCCCCCC(O)C(O)CC1OC1CCCC)OC(=O)CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H98O11/c1-4-7-10-12-13-14-15-16-17-18-19-20-26-34-41-54(61)64-45(43-62-52(59)39-32-27-21-24-30-36-47(56)46(55)35-29-23-11-8-5-2)44-63-53(60)40-33-28-22-25-31-37-48(57)49(58)42-51-50(65-51)38-9-6-3/h23,29,45,47-51,56-58H,4-22,24-28,30-44H2,1-3H3/b29-23?/t45?,47?,48?,49?,50?,51? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:26][CH2:34][CH2:41][C:54](=[O:61])[O:64][CH:45]([CH2:43][O:62][C:52]([CH2:39][CH2:32][CH2:27][CH2:21][CH2:24][CH2:30][CH2:36][CH:47]([C:46]([CH2:35][CH:29]=[CH:23][CH2:11][CH2:8][CH2:5][CH3:2])=[O:55])[OH:56])=[O:59])[CH2:44][O:63][C:53]([CH2:40][CH2:33][CH2:28][CH2:22][CH2:25][CH2:31][CH2:37][CH:48]([CH:49]([CH2:42][CH:51]1[CH:50]([CH2:38][CH2:9][CH2:6][CH3:3])[O:65]1)[OH:58])[OH:57])=[O:60] |
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