| Properties | Image |
|---|
| MNX_ID | MNXM105671 |
 |
| reference | chebi:69625 |
| formula | C32H52O5 |
| global charge | 0 |
| mol weight | 516.763 |
| InChIKey | FGFAOYBESHLCOZ-ITVSTCJBSA-N |
| InChI | InChI=1S/C32H52O5/c1-19(33)37-25-14-15-30(6)24(28(25,2)3)11-10-22-27(30)23(34)17-32(8)21(13-16-31(22,32)7)20-9-12-26(36-18-20)29(4,5)35/h20-21,23-26,34-35H,9-18H2,1-8H3/t20-,21+,23+,24-,25-,26+,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[C@H]3O |
MNX internals
| InChI (mnx) | InChI=1/C32H52O5/c1-19(33)37-25-14-15-30(6)24(28(25,2)3)11-10-22-27(30)23(34)17-32(8)21(13-16-31(22,32)7)20-9-12-26(36-18-20)29(4,5)35/h20-21,23-26,34-35H,9-18H2,1-8H3/t20-,21+,23+,24-,25-,26+,30-,31-,32+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:19](=[O:33])[O:37][C@H:25]1[CH2:14][CH2:15][C@@:30]2([CH3:6])[C@@H:24]([CH2:11][CH2:10][C:22]3=[C:27]2[C@H:23]([OH:34])[CH2:17][C@:32]2([CH3:8])[C@@H:21]([C@H:20]4[CH2:9][CH2:12][C@H:26]([C:29]([CH3:4])([CH3:5])[OH:35])[O:36][CH2:18]4)[CH2:13][CH2:16][C@@:31]32[CH3:7])[C:28]1([CH3:2])[CH3:3] |
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