| Properties | Image |
|---|
| MNX_ID | MNXM1182294 |
 |
| reference | envipathM:...3ba48433baee |
| formula | C37H64O12 |
| global charge | 0 |
| mol weight | 700.907 |
| InChIKey | JZGLAFYOHVWNGD-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O12/c1-3-15-28(41)37-33(49-37)22-32-31(48-32)18-11-7-5-9-13-21-35(43)46-24-26(39)23-45-34(42)20-12-8-4-6-10-17-29-30(47-29)19-14-16-27(40)36(44)25(2)38/h14,16,25-33,36-41,44H,3-13,15,17-24H2,1-2H3 |
| SMILES | CCCC(O)C1OC1CC1OC1CCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCC1OC1CC=CC(O)C(O)C(C)O |
MNX internals
| InChI (mnx) | InChI=1/C37H64O12/c1-3-15-28(41)37-33(49-37)22-32-31(48-32)18-11-7-5-9-13-21-35(43)46-24-26(39)23-45-34(42)20-12-8-4-6-10-17-29-30(47-29)19-14-16-27(40)36(44)25(2)38/h14,16,25-33,36-41,44H,3-13,15,17-24H2,1-2H3/b16-14?/t25?,26?,27?,28?,29?,30?,31?,32?,33?,36?,37? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:15][CH:28]([CH:37]1[CH:33]([CH2:22][CH:32]2[CH:31]([CH2:18][CH2:11][CH2:7][CH2:5][CH2:9][CH2:13][CH2:21][C:35](=[O:43])[O:46][CH2:24][CH:26]([CH2:23][O:45][C:34]([CH2:20][CH2:12][CH2:8][CH2:4][CH2:6][CH2:10][CH2:17][CH:29]3[CH:30]([CH2:19][CH:14]=[CH:16][CH:27]([CH:36]([CH:25]([CH3:2])[OH:38])[OH:44])[OH:40])[O:47]3)=[O:42])[OH:39])[O:48]2)[O:49]1)[OH:41] |
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