| Properties | Image |
|---|
| MNX_ID | MNXM1190226 |
 |
| reference | envipathM:...42f1e0fb438a |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | LZPBPECCFZXPNL-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-7-8-9-12-19-27-41(56)28-20-17-18-25-35-50(61)65-43(39-63-48(59)33-23-15-10-13-21-31-45-52(66-45)44(58)37-36-42(57)29-26-38-55)40-64-49(60)34-24-16-11-14-22-32-47-54(68-47)51(62)53-46(67-53)30-6-4-2/h8-9,19,27,36-37,41-47,51-58,62H,3-7,10-18,20-26,28-35,38-40H2,1-2H3 |
| SMILES | CCCCC=CCC=CC(O)CCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1C(O)C=CC(O)CCCO)COC(=O)CCCCCCCC1OC1C(O)C1OC1CCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-7-8-9-12-19-27-41(56)28-20-17-18-25-35-50(61)65-43(39-63-48(59)33-23-15-10-13-21-31-45-52(66-45)44(58)37-36-42(57)29-26-38-55)40-64-49(60)34-24-16-11-14-22-32-47-54(68-47)51(62)53-46(67-53)30-6-4-2/h8-9,19,27,36-37,41-47,51-58,62H,3-7,10-18,20-26,28-35,38-40H2,1-2H3/b9-8?,27-19?,37-36?/t41?,42?,43?,44?,45?,46?,47?,51?,52?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:8]=[CH:9][CH2:12][CH:19]=[CH:27][CH:41]([CH2:28][CH2:20][CH2:17][CH2:18][CH2:25][CH2:35][C:50](=[O:61])[O:65][CH:43]([CH2:39][O:63][C:48]([CH2:33][CH2:23][CH2:15][CH2:10][CH2:13][CH2:21][CH2:31][CH:45]1[CH:52]([CH:44]([CH:37]=[CH:36][CH:42]([CH2:29][CH2:26][CH2:38][OH:55])[OH:57])[OH:58])[O:66]1)=[O:59])[CH2:40][O:64][C:49]([CH2:34][CH2:24][CH2:16][CH2:11][CH2:14][CH2:22][CH2:32][CH:47]1[CH:54]([CH:51]([CH:53]2[CH:46]([CH2:30][CH2:6][CH2:4][CH3:2])[O:67]2)[OH:62])[O:68]1)=[O:60])[OH:56] |
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