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tirucalladienol
MNXM169250 is deprecated and replaced by MNXM5954
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM5954 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 1 |
| in models (compartimentalized) |
1 |
|
| formula | C30H50O |
| charge | 0 |
| mass | 426.38617 |
| reference | chebi:63468 |
| InChIKey | DICCPNLDOZNSML-CEEMYSEHSA-N |
| InChI | InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,12,21-23,25-26,31H,9,11,13-19H2,1-8H3/t21-,22-,23-,25-,26-,28+,29-,30+/m0/s1 |
| SMILES | CC(C)=CCC[C@H](C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
| Identifier | Description |
|---|
CHEBI:63468
chebi:63468
| tirucalladienol
(13alpha,14beta,17alpha,20S)-lanosta-7,24-dien-3beta-ol
(3beta,13alpha,14beta,17alpha,20S)-lanosta-7,24-dien-3-ol
5alpha-tirucalla-7,24-dien-3beta-ol
Delta(7)-tirucallol
tirucalla-7,24-dien-3beta-ol
|
seed.compound:cpd21428
seedM:cpd21428
kegg.compound:C20195
keggC:C20195
| Tirucalla-7,24-dien-3beta-ol
|
metacyc.compound:CPD-13276
metacycM:CPD-13276
seed.compound:cpd23808
seedM:cpd23808
| tirucalla-7,24-diene-3beta-ol
|
keggC:M_C20195
seedM:M_cpd21428
seedM:M_cpd23808
| secondary/obsolete/fantasy identifier
|
