| Properties | Image |
|---|
| MNX_ID | MNXM1175159 |
 |
| reference | envipathM:...20518e1e9a29 |
| formula | C54H96O14 |
| global charge | 0 |
| mol weight | 969.348 |
| InChIKey | OGMUAFRTCAOUDU-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H96O14/c1-3-5-7-9-10-11-12-13-14-15-16-17-20-29-38-52(62)67-43(42-66-54(64)47(59)35-26-23-22-25-34-46(58)53(63)45(57)33-24-8-6-4-2)41-65-51(61)37-28-21-18-19-27-36-49-50(68-49)40-48(60)44(56)32-30-31-39-55/h9-10,12-13,24,33,43-50,53,55-60,63H,3-8,11,14-23,25-32,34-42H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC(O)C(O)CCCCO)COC(=O)C(O)CCCCCCC(O)C(O)C(O)C=CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H96O14/c1-3-5-7-9-10-11-12-13-14-15-16-17-20-29-38-52(62)67-43(42-66-54(64)47(59)35-26-23-22-25-34-46(58)53(63)45(57)33-24-8-6-4-2)41-65-51(61)37-28-21-18-19-27-36-49-50(68-49)40-48(60)44(56)32-30-31-39-55/h9-10,12-13,24,33,43-50,53,55-60,63H,3-8,11,14-23,25-32,34-42H2,1-2H3/b10-9?,13-12?,33-24?/t43?,44?,45?,46?,47?,48?,49?,50?,53? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH:9]=[CH:10][CH2:11][CH:12]=[CH:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:20][CH2:29][CH2:38][C:52](=[O:62])[O:67][CH:43]([CH2:41][O:65][C:51]([CH2:37][CH2:28][CH2:21][CH2:18][CH2:19][CH2:27][CH2:36][CH:49]1[CH:50]([CH2:40][CH:48]([CH:44]([CH2:32][CH2:30][CH2:31][CH2:39][OH:55])[OH:56])[OH:60])[O:68]1)=[O:61])[CH2:42][O:66][C:54]([CH:47]([CH2:35][CH2:26][CH2:23][CH2:22][CH2:25][CH2:34][CH:46]([CH:53]([CH:45]([CH:33]=[CH:24][CH2:8][CH2:6][CH2:4][CH3:2])[OH:57])[OH:63])[OH:58])[OH:59])=[O:64] |
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