| Properties | Image |
|---|
| MNX_ID | MNXM105672 |
 |
| reference | chebi:69626 |
| formula | C32H50O4 |
| global charge | 0 |
| mol weight | 498.748 |
| InChIKey | PALMMJQAPKRBJB-RRZFRIRNSA-N |
| InChI | InChI=1S/C32H50O4/c1-20(33)36-26-15-16-30(6)23-14-18-31(7)22(21-9-12-27(35-19-21)29(4,5)34)13-17-32(31,8)24(23)10-11-25(30)28(26,2)3/h14,18,21-22,25-27,34H,9-13,15-17,19H2,1-8H3/t21-,22+,25-,26-,27+,30+,31+,32-/m0/s1 |
| SMILES | CC(=O)O[C@H]1CC[C@]2(C)C3=C(CC[C@H]2C1(C)C)[C@]1(C)CC[C@H]([C@H]2CC[C@H](C(C)(C)O)OC2)[C@@]1(C)C=C3 |
MNX internals
| InChI (mnx) | InChI=1/C32H50O4/c1-20(33)36-26-15-16-30(6)23-14-18-31(7)22(21-9-12-27(35-19-21)29(4,5)34)13-17-32(31,8)24(23)10-11-25(30)28(26,2)3/h14,18,21-22,25-27,34H,9-13,15-17,19H2,1-8H3/t21-,22+,25-,26-,27+,30+,31+,32-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:20](=[O:33])[O:36][C@H:26]1[CH2:15][CH2:16][C@:30]2([CH3:6])[C:23]3=[C:24]([CH2:10][CH2:11][C@H:25]2[C:28]1([CH3:2])[CH3:3])[C@:32]1([CH3:8])[CH2:17][CH2:13][C@H:22]([C@H:21]2[CH2:9][CH2:12][C@H:27]([C:29]([CH3:4])([CH3:5])[OH:34])[O:35][CH2:19]2)[C@@:31]1([CH3:7])[CH:18]=[CH:14]3 |
|