Showing entry for Cinnamodial
| General Compound Information | |
|---|---|
| BXGC Id | BXGC0022657 |
| Compound Name | Cinnamodial |
| Structure | ![]() |
| Formula | C17H24O5 |
| InchiKey | UKLMEFSRPRDOLD-YQFWSFKMSA-N |
| SMILES | O=CC1=C[C@@H](OC(=O)C)[C@@H]2[C@]([C@@]1(O)C=O)(C)CCCC2(C)C |
| Inchi | InChI=1S/C17H24O5/c1-11(20)22-13-8-12(9-18)17(21,10-19)16(4)7-5-6-15(2,3)14(13)16/h8-10,13-14,21H,5-7H2,1-4H3/t13-,14+,16+,17-/m1/s1 |
| IUPAC | [(1R,4S,4aS,8aS)-3,4-diformyl-4-hydroxy-4a,8,8-trimethyl-5,6,7,8a-tetrahydro-1H-naphthalen-1-yl] acetate |
| Molecular Weight | 308.16 |
| Pubchem Id | 442354 |
| Chembl Id | CHEMBL373458 |
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| DrugBank | n.a |
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| PDB | n.a |
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| Binding DB | n.a |
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| CHEMBL | CHEMBL373458 |
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