2D Chemical StructureDatabase ID 16743101
No renderable structure data available
SMILES
C[C@@H]1[C@@H]2[C@@H](C[C@@H]3CC(=O)CC[C@H]3[C@@H]2C(=O)O)C(=O)O1Structure data verified · Database ID 16743101
Chemical Intermediate
(1R,3aR,4aR,8aR,9S,9aR)-1-methyl-3,6-dioxo-1,3a,4,4a,5,7,8,8a,9,9a-decahydrobenzo[f][2]benzofuran-9-carboxylic acid
CAS 900161-05-9Product ID 565809
| Intermediates | (1R,3aR,4aR,8aR,9S,9aR)-1-methyl-3,6-dioxo-1,3a,4,4a,5,7,8,8a,9,9a-decahydrobenzo[f][2]benzofuran-9-carboxylic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 900161-05-9 |
| Database ID | 16743101 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
(1R,3aR,4aR,8aR,9S,9aR)-1-methyl-3,6-dioxo-1,3a,4,4a,5,7,8,8a,9,9a-decahydrobenzo[f][2]benzofuran-9-carboxylic acid
(1R,3aR,4aR,8aR,9S,9aR)-1-methyl-3,6-dioxo-1,3a,4,4a,5,7,8,8a,9,9a-decahydrobenzo[f][2]benzofuran-9-carboxylic acid (CAS 900161-05-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number900161-05-9
Database ID16743101
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 16743101
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C[C@@H]1[C@@H]2[C@@H](C[C@@H]3CC(=O)CC[C@H]3[C@@H]2C(=O)O)C(=O)O1
- InChI
- —
Safety Notice
Safety & Notes
For professional research and industrial use only. Review the supplier safety data sheet before handling.
PubChem References
Public References
These sources are listed in the compound's public database record.
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CAS 900161-05-9(1R,3aR,4aR,8aR,9S,9aR)-1-methyl-3,6-dioxo-1,3a,4,4a,5,7,8,8a,9,9a-decahydrobenzo[f][2]benzofuran-9-carboxylic acid
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