| Properties | Image |
|---|
| MNX_ID | MNXM1139023 |
 |
| reference | envipathM:...e6ada867bbe8 |
| formula | C54H92O14 |
| global charge | 0 |
| mol weight | 965.316 |
| InChIKey | XFBSSLQULKCTPY-UHFFFAOYSA-N |
| InChI | InChI=1S/C54H92O14/c1-3-5-6-7-8-9-10-11-12-13-14-15-20-27-36-52(62)65-41(39-63-50(60)34-25-21-16-18-23-32-46-48(66-46)37-49-54(68-49)43(57)29-4-2)40-64-51(61)35-26-22-17-19-24-33-47-53(67-47)44(58)31-28-30-42(56)45(59)38-55/h7-8,10-11,28,31,41-49,53-59H,3-6,9,12-27,29-30,32-40H2,1-2H3 |
| SMILES | CCCCC=CCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCC1OC1CC1OC1C(O)CCC)COC(=O)CCCCCCCC1OC1C(O)C=CCC(O)C(O)CO |
MNX internals
| InChI (mnx) | InChI=1/C54H92O14/c1-3-5-6-7-8-9-10-11-12-13-14-15-20-27-36-52(62)65-41(39-63-50(60)34-25-21-16-18-23-32-46-48(66-46)37-49-54(68-49)43(57)29-4-2)40-64-51(61)35-26-22-17-19-24-33-47-53(67-47)44(58)31-28-30-42(56)45(59)38-55/h7-8,10-11,28,31,41-49,53-59H,3-6,9,12-27,29-30,32-40H2,1-2H3/b8-7?,11-10?,31-28?/t41?,42?,43?,44?,45?,46?,47?,48?,49?,53?,54? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:7]=[CH:8][CH2:9][CH:10]=[CH:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:20][CH2:27][CH2:36][C:52](=[O:62])[O:65][CH:41]([CH2:39][O:63][C:50]([CH2:34][CH2:25][CH2:21][CH2:16][CH2:18][CH2:23][CH2:32][CH:46]1[CH:48]([CH2:37][CH:49]2[CH:54]([CH:43]([CH2:29][CH2:4][CH3:2])[OH:57])[O:68]2)[O:66]1)=[O:60])[CH2:40][O:64][C:51]([CH2:35][CH2:26][CH2:22][CH2:17][CH2:19][CH2:24][CH2:33][CH:47]1[CH:53]([CH:44]([CH:31]=[CH:28][CH2:30][CH:42]([CH:45]([CH2:38][OH:55])[OH:59])[OH:56])[OH:58])[O:67]1)=[O:61] |
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