| Properties | Image |
|---|
| MNX_ID | MNXM1177708 |
 |
| reference | envipathM:...17d4b776e592 |
| formula | C37H64O11 |
| global charge | 0 |
| mol weight | 684.908 |
| InChIKey | DBJPXPMHGRYWNP-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O11/c1-3-5-23-31-34(47-31)33(42)35-32(48-35)24-18-14-13-17-21-29(40)36(43)45-26-28(25-38)46-37(44)30(41)22-16-12-10-8-6-7-9-11-15-20-27(39)19-4-2/h7,9,15,20,27-35,38-42H,3-6,8,10-14,16-19,21-26H2,1-2H3 |
| SMILES | CCCCC1OC1C(O)C1OC1CCCCCCC(O)C(=O)OCC(CO)OC(=O)C(O)CCCCCCC=CCC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O11/c1-3-5-23-31-34(47-31)33(42)35-32(48-35)24-18-14-13-17-21-29(40)36(43)45-26-28(25-38)46-37(44)30(41)22-16-12-10-8-6-7-9-11-15-20-27(39)19-4-2/h7,9,15,20,27-35,38-42H,3-6,8,10-14,16-19,21-26H2,1-2H3/b9-7?,20-15?/t27?,28?,29?,30?,31?,32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:23][CH:31]1[CH:34]([CH:33]([CH:35]2[CH:32]([CH2:24][CH2:18][CH2:14][CH2:13][CH2:17][CH2:21][CH:29]([C:36](=[O:43])[O:45][CH2:26][CH:28]([CH2:25][OH:38])[O:46][C:37]([CH:30]([CH2:22][CH2:16][CH2:12][CH2:10][CH2:8][CH2:6][CH:7]=[CH:9][CH2:11][CH:15]=[CH:20][CH:27]([CH2:19][CH2:4][CH3:2])[OH:39])[OH:41])=[O:44])[OH:40])[O:48]2)[OH:42])[O:47]1 |
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