Account Orthosiphol B
- Catalog No. :
- ACYCZS459
- CAS No. :
- 144078-08-0
- Molecular Formula :
- C38H44O11
- Molecular Weight :
- 676.76
IUPAC Name:(2S,3S,4R,4aS,4bS,5R,7R,8aR,9R,10aS)-2,9-diacetoxy-3,8a-dihydroxy-1,1,4a,7-tetramethyl-8-oxo-7-vinyltetradecahydrophenanthrene-4,5-diyl dibenzoate
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Product Information
| Product Name | Orthosiphol B |
|---|---|
| IUPAC Name | (2S,3S,4R,4aS,4bS,5R,7R,8aR,9R,10aS)-2,9-diacetoxy-3,8a-dihydroxy-1,1,4a,7-tetramethyl-8-oxo-7-vinyltetradecahydrophenanthrene-4,5-diyl dibenzoate |
| Molecular Formula | C38H44O11 |
| Molecular Weight | 676.76 |
| SMILES | C[C@@]12[C@@]3([C@@](O)([C@H](OC(C)=O)C[C@]1(C(C)(C)[C@H](OC(C)=O)[C@H](O)[C@@H]2OC(=O)C4=CC=CC=C4)[H])C(=O)[C@](C=C)(C)C[C@H]3OC(=O)C5=CC=CC=C5)[H] |
| InChI Key | BXKNTIMTKVZYDP-OFUWLHILSA-N |
| Synonym | Orthosiphol B;1(2H)-Phenanthrenone, 7,10-bis(acetyloxy)-4,5-bis(benzoyloxy)-2-ethenyldodecahydro-6,10a-dihydroxy-2,4b,8,8-tetramethyl-, (2R,4R,4aS,4bS,5R,6S,7S,8aS,10R,10aR)- |
| CAS No. | 144078-08-0 |
Synthetic Route by SureRoute
2. ACYCZS459 Molecular Building Block Synthetic Route
Orthosiphol A
Neoorthosiphol A
(1S,3aR,4R,5R,5aR,7S,9S,9aR,10R,11S,11aR,12S)-9a-((benzoyloxy)methyl)-7,11a-dihydroxy-12-(hydroxymethyl)-1,3a-dimethyl-6-methylene-13-oxotetradecahydro-4,1-ethanobenzo[5,6]cycloocta[1,2-c]furan-5,9,10,11-tetrayl tetraacetate