| Properties | Image |
|---|
| MNX_ID | MNXM1192054 |
 |
| reference | envipathM:...2ed0fd79a094 |
| formula | C37H64O12 |
| global charge | 0 |
| mol weight | 700.907 |
| InChIKey | NFWTYGRGELVCMY-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O12/c1-3-5-18-31-35(48-31)34(43)36-32(49-36)20-13-7-6-8-14-22-33(42)45-23-25(38)24-46-37(44)28(41)16-11-9-10-12-19-29-30(47-29)21-15-17-27(40)26(39)4-2/h15,17,25-32,34-36,38-41,43H,3-14,16,18-24H2,1-2H3 |
| SMILES | CCCCC1OC1C(O)C1OC1CCCCCCCC(=O)OCC(O)COC(=O)C(O)CCCCCCC1OC1CC=CC(O)C(O)CC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O12/c1-3-5-18-31-35(48-31)34(43)36-32(49-36)20-13-7-6-8-14-22-33(42)45-23-25(38)24-46-37(44)28(41)16-11-9-10-12-19-29-30(47-29)21-15-17-27(40)26(39)4-2/h15,17,25-32,34-36,38-41,43H,3-14,16,18-24H2,1-2H3/b17-15?/t25?,26?,27?,28?,29?,30?,31?,32?,34?,35?,36? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:18][CH:31]1[CH:35]([CH:34]([CH:36]2[CH:32]([CH2:20][CH2:13][CH2:7][CH2:6][CH2:8][CH2:14][CH2:22][C:33](=[O:42])[O:45][CH2:23][CH:25]([CH2:24][O:46][C:37]([CH:28]([CH2:16][CH2:11][CH2:9][CH2:10][CH2:12][CH2:19][CH:29]3[CH:30]([CH2:21][CH:15]=[CH:17][CH:27]([CH:26]([CH2:4][CH3:2])[OH:39])[OH:40])[O:47]3)[OH:41])=[O:44])[OH:38])[O:49]2)[OH:43])[O:48]1 |
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