| Properties | Image |
|---|
| MNX_ID | MNXM101911 |
 |
| reference | chebi:69631 |
| formula | C32H52O3 |
| global charge | 0 |
| mol weight | 484.765 |
| InChIKey | QSVUNIKEYUWHML-GDHXYORVSA-N |
| InChI | InChI=1S/C32H52O3/c1-19(2)21-12-15-29(6)22(21)18-26(34)32(9)25(29)11-10-24-30(7)16-14-27(35-20(3)33)28(4,5)23(30)13-17-31(24,32)8/h21-27,34H,1,10-18H2,2-9H3/t21-,22+,23+,24-,25-,26+,27+,29+,30+,31-,32+/m1/s1 |
| SMILES | C=C(C)[C@H]1CC[C@]2(C)[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)[C@@H](O)C[C@@H]12 |
MNX internals
| InChI (mnx) | InChI=1/C32H52O3/c1-19(2)21-12-15-29(6)22(21)18-26(34)32(9)25(29)11-10-24-30(7)16-14-27(35-20(3)33)28(4,5)23(30)13-17-31(24,32)8/h21-27,34H,1,10-18H2,2-9H3/t21-,22+,23+,24-,25-,26+,27+,29+,30+,31-,32+/m1/s1 |
 |
| SMILES (mnx) | [CH2:1]=[C:19]([CH3:2])[C@H:21]1[CH2:12][CH2:15][C@@:29]2([CH3:6])[C@H:22]1[CH2:18][C@H:26]([OH:34])[C@:32]1([CH3:9])[C@@H:25]2[CH2:11][CH2:10][C@@H:24]2[C@@:30]3([CH3:7])[CH2:16][CH2:14][C@H:27]([O:35][C:20]([CH3:3])=[O:33])[C:28]([CH3:4])([CH3:5])[C@@H:23]3[CH2:13][CH2:17][C@:31]21[CH3:8] |
|