| Properties | Image |
|---|
| MNX_ID | MNXM26626 |
 |
| reference | chebi:229819 |
| formula | C27H44O4 |
| global charge | 0 |
| mol weight | 432.645 |
| InChIKey | SUKPXTNRRMFHTM-BCBAPGJRSA-N |
| InChI | InChI=1S/C27H44O4/c1-17(2)7-6-8-18(3)20-9-10-21-22-15-23(29)27-16-19(28)11-12-25(27,5)26(22,30-31-27)14-13-24(20,21)4/h15,17-21,23,28-29H,6-14,16H2,1-5H3/t18-,19+,20-,21+,23+,24-,25-,26-,27+/m1/s1 |
| SMILES | CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2C3=C[C@H](O)[C@@]45C[C@@H](O)CC[C@]4(C)[C@]3(CC[C@]12C)OO5 |
MNX internals
| InChI (mnx) | InChI=1/C27H44O4/c1-17(2)7-6-8-18(3)20-9-10-21-22-15-23(29)27-16-19(28)11-12-25(27,5)26(22,30-31-27)14-13-24(20,21)4/h15,17-21,23,28-29H,6-14,16H2,1-5H3/t18-,19+,20-,21+,23+,24-,25-,26-,27+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH:17]([CH3:2])[CH2:7][CH2:6][CH2:8][C@@H:18]([CH3:3])[C@H:20]1[CH2:9][CH2:10][C@H:21]2[C:22]3=[CH:15][C@H:23]([OH:29])[C@@:27]45[CH2:16][C@@H:19]([OH:28])[CH2:11][CH2:12][C@:25]4([CH3:5])[C@:26]3([CH2:14][CH2:13][C@:24]12[CH3:4])[O:30][O:31]5 |
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