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phyllocladan-16alpha-ol
MNXM164757 is deprecated and here replaced by MNXM731062
!!! Alternative mappings exist !!!
| Properties | Image |
|---|
| MNX_ID | MNXM731062 |
 |
| reference | chebi:53643 |
| formula | C20H34O |
| global charge | 0 |
| mol weight | 290.491 |
| InChIKey | FZSRMADKTOBCNT-LOBZHTCKSA-N |
| InChI | InChI=1S/C20H34O/c1-17(2)9-5-10-18(3)15(17)8-11-20-12-14(6-7-16(18)20)19(4,21)13-20/h14-16,21H,5-13H2,1-4H3/t14-,15-,16+,18-,19+,20+/m0/s1 |
| SMILES | CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]13C[C@H](CC[C@@H]12)[C@](C)(O)C3 |
MNX internals
| InChI (mnx) | InChI=1/C20H34O/c1-17(2)9-5-10-18(3)15(17)8-11-20-12-14(6-7-16(18)20)19(4,21)13-20/h14-16,21H,5-13H2,1-4H3/t14-,15-,16+,18-,19+,20+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:17]1([CH3:2])[CH2:9][CH2:5][CH2:10][C@@:18]2([CH3:3])[C@H:15]1[CH2:8][CH2:11][C@:20]13[CH2:12][C@H:14]([CH2:6][CH2:7][C@H:16]21)[C@:19]([CH3:4])([OH:21])[CH2:13]3 |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 1 |
| in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
| Identifier | Description |
|---|
CHEBI:53643
chebi:53643
FZSRMADKTOBCNT-LOBZHTCKSA-N
| phyllocladan-16alpha-ol
(13alpha,16beta)-kauran-16-ol
|