| Properties | Image |
|---|
| MNX_ID | MNXM102780 |
 |
| reference | chebi:65420 |
| formula | C25H40O5 |
| global charge | 0 |
| mol weight | 420.59 |
| InChIKey | BYAXMGMKQCMKDN-MWOZSAKHSA-N |
| InChI | InChI=1S/C25H40O5/c1-18(9-12-22-24(2,3)13-6-14-25(22,4)29)7-5-8-19(16-26)10-11-21-20(17-27)15-23(28)30-21/h7,10,15,21-22,26-27,29H,5-6,8-9,11-14,16-17H2,1-4H3/b18-7+,19-10-/t21?,22-,25-/m0/s1 |
| SMILES | C/C(=C\CC/C(=C/CC1OC(=O)C=C1CO)CO)CC[C@H]1C(C)(C)CCC[C@]1(C)O |
MNX internals
| InChI (mnx) | InChI=1/C25H40O5/c1-18(9-12-22-24(2,3)13-6-14-25(22,4)29)7-5-8-19(16-26)10-11-21-20(17-27)15-23(28)30-21/h7,10,15,21-22,26-27,29H,5-6,8-9,11-14,16-17H2,1-4H3/b18-7+,19-10-/t21?,22-,25-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1]/[C:18](=[CH:7]\[CH2:5][CH2:8]/[C:19](=[CH:10]/[CH2:11][CH:21]1[C:20]([CH2:17][OH:27])=[CH:15][C:23](=[O:28])[O:30]1)[CH2:16][OH:26])[CH2:9][CH2:12][C@H:22]1[C:24]([CH3:2])([CH3:3])[CH2:13][CH2:6][CH2:14][C@:25]1([CH3:4])[OH:29] |
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