| Properties | Image |
|---|
| MNX_ID | MNXM103496 |
 |
| reference | chebi:65575 |
| formula | C20H32O5 |
| global charge | 0 |
| mol weight | 352.471 |
| InChIKey | JLCJNFREUBTKDT-WRHAGOLESA-N |
| InChI | InChI=1S/C20H32O5/c1-13-6-5-10-19(3,24)17(22)12-15-9-11-20(4,16(21)8-7-13)25-18(23)14(15)2/h6,15-17,21-22,24H,2,5,7-12H2,1,3-4H3/b13-6+/t15-,16+,17-,19+,20-/m1/s1 |
| SMILES | C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)[C@@](C)(O)CC/C=C(\C)CC[C@@H]2O |
MNX internals
| InChI (mnx) | InChI=1/C20H32O5/c1-13-6-5-10-19(3,24)17(22)12-15-9-11-20(4,16(21)8-7-13)25-18(23)14(15)2/h6,15-17,21-22,24H,2,5,7-12H2,1,3-4H3/b13-6+/t15-,16+,17-,19+,20-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1]/[C:13]1=[CH:6]\[CH2:5][CH2:10][C@:19]([CH3:3])([OH:24])[C@H:17]([OH:22])[CH2:12][C@H:15]2[CH2:9][CH2:11][C@:20]([CH3:4])([C@@H:16]([OH:21])[CH2:8][CH2:7]1)[O:25][C:18](=[O:23])[C:14]2=[CH2:2] |
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