| Properties | Image |
|---|
| MNX_ID | MNXM1184284 |
 |
| reference | envipathM:...d07f42b154d2 |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | UHVNUUUADHDNNF-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-7-9-10-13-20-29-41(56)30-21-16-18-27-37-49(61)65-42(39-63-47(59)35-25-15-11-14-24-34-46-45(66-46)33-23-12-8-6-4-2)40-64-48(60)36-26-19-17-22-31-43(57)51-53(67-51)50(62)54-52(68-54)44(58)32-28-38-55/h9-10,12,20,23,29,41-46,50-58,62H,3-8,11,13-19,21-22,24-28,30-40H2,1-2H3 |
| SMILES | CCCCC=CCC=CC(O)CCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC=CCCCC)COC(=O)CCCCCCC(O)C1OC1C(O)C1OC1C(O)CCCO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-7-9-10-13-20-29-41(56)30-21-16-18-27-37-49(61)65-42(39-63-47(59)35-25-15-11-14-24-34-46-45(66-46)33-23-12-8-6-4-2)40-64-48(60)36-26-19-17-22-31-43(57)51-53(67-51)50(62)54-52(68-54)44(58)32-28-38-55/h9-10,12,20,23,29,41-46,50-58,62H,3-8,11,13-19,21-22,24-28,30-40H2,1-2H3/b10-9?,23-12?,29-20?/t41?,42?,43?,44?,45?,46?,50?,51?,52?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:13][CH:20]=[CH:29][CH:41]([CH2:30][CH2:21][CH2:16][CH2:18][CH2:27][CH2:37][C:49](=[O:61])[O:65][CH:42]([CH2:39][O:63][C:47]([CH2:35][CH2:25][CH2:15][CH2:11][CH2:14][CH2:24][CH2:34][CH:46]1[CH:45]([CH2:33][CH:23]=[CH:12][CH2:8][CH2:6][CH2:4][CH3:2])[O:66]1)=[O:59])[CH2:40][O:64][C:48]([CH2:36][CH2:26][CH2:19][CH2:17][CH2:22][CH2:31][CH:43]([CH:51]1[CH:53]([CH:50]([CH:54]2[CH:52]([CH:44]([CH2:32][CH2:28][CH2:38][OH:55])[OH:58])[O:68]2)[OH:62])[O:67]1)[OH:57])=[O:60])[OH:56] |
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