| Properties | Image |
|---|
| MNX_ID | MNXM1172003 |
 |
| reference | envipathM:...f176f523d714 |
| formula | C37H64O10 |
| global charge | 0 |
| mol weight | 668.909 |
| InChIKey | HKLIXHGOOHIDQD-UHFFFAOYSA-N |
| InChI | InChI=1S/C37H64O10/c1-3-5-6-13-20-30(40)21-14-9-7-8-10-15-24-33(42)37(44)46-31(27-38)28-45-36(43)32(41)23-16-11-12-17-25-34-35(47-34)26-18-22-29(39)19-4-2/h13-14,18,20-22,29-35,38-42H,3-12,15-17,19,23-28H2,1-2H3 |
| SMILES | CCCCC=CC(O)C=CCCCCCCC(O)C(=O)OC(CO)COC(=O)C(O)CCCCCCC1OC1CC=CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C37H64O10/c1-3-5-6-13-20-30(40)21-14-9-7-8-10-15-24-33(42)37(44)46-31(27-38)28-45-36(43)32(41)23-16-11-12-17-25-34-35(47-34)26-18-22-29(39)19-4-2/h13-14,18,20-22,29-35,38-42H,3-12,15-17,19,23-28H2,1-2H3/b20-13?,21-14?,22-18?/t29?,30?,31?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH:13]=[CH:20][CH:30]([CH:21]=[CH:14][CH2:9][CH2:7][CH2:8][CH2:10][CH2:15][CH2:24][CH:33]([C:37](=[O:44])[O:46][CH:31]([CH2:27][OH:38])[CH2:28][O:45][C:36]([CH:32]([CH2:23][CH2:16][CH2:11][CH2:12][CH2:17][CH2:25][CH:34]1[CH:35]([CH2:26][CH:18]=[CH:22][CH:29]([CH2:19][CH2:4][CH3:2])[OH:39])[O:47]1)[OH:41])=[O:43])[OH:42])[OH:40] |
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