| Properties | Image |
|---|
| MNX_ID | MNXM1192776 |
 |
| reference | envipathM:...7dbd39bc2599 |
| formula | C54H96O12 |
| global charge | 0 |
| mol weight | 937.35 |
| InChIKey | CXCNQERZWSCIME-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H96O12/c1-4-7-8-9-10-11-12-13-14-15-16-19-24-33-45(57)54(60)63-43(40-61-51(58)37-27-22-17-20-25-34-46-47(64-46)36-29-32-42(55)30-5-2)41-62-52(59)38-28-23-18-21-26-35-48-49(65-48)39-50-53(66-50)44(56)31-6-3/h9-10,42-50,53,55-57H,4-8,11-41H2,1-3H3 |
| SMILES | CCCCC=CCCCCCCCCCC(O)C(=O)OC(COC(=O)CCCCCCCC1OC1CCCC(O)CCC)COC(=O)CCCCCCCC1OC1CC1OC1C(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C54H96O12/c1-4-7-8-9-10-11-12-13-14-15-16-19-24-33-45(57)54(60)63-43(40-61-51(58)37-27-22-17-20-25-34-46-47(64-46)36-29-32-42(55)30-5-2)41-62-52(59)38-28-23-18-21-26-35-48-49(65-48)39-50-53(66-50)44(56)31-6-3/h9-10,42-50,53,55-57H,4-8,11-41H2,1-3H3/b10-9?/t42?,43?,44?,45?,46?,47?,48?,49?,50?,53? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:8][CH:9]=[CH:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:19][CH2:24][CH2:33][CH:45]([C:54](=[O:60])[O:63][CH:43]([CH2:40][O:61][C:51]([CH2:37][CH2:27][CH2:22][CH2:17][CH2:20][CH2:25][CH2:34][CH:46]1[CH:47]([CH2:36][CH2:29][CH2:32][CH:42]([CH2:30][CH2:5][CH3:2])[OH:55])[O:64]1)=[O:58])[CH2:41][O:62][C:52]([CH2:38][CH2:28][CH2:23][CH2:18][CH2:21][CH2:26][CH2:35][CH:48]1[CH:49]([CH2:39][CH:50]2[CH:53]([CH:44]([CH2:31][CH2:6][CH3:3])[OH:56])[O:66]2)[O:65]1)=[O:59])[OH:57] |
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