Account Neoorthosiphol A
- Catalog No. :
- ACSNGV258
- CAS No. :
- 243448-72-8
- Molecular Formula :
- C38H44O12
- Molecular Weight :
- 692.76
IUPAC Name:(2S,3S,4R,4aS,4bS,5R,6S,7S,8aR,9R,10aS)-3,9-diacetoxy-2,7,8a-trihydroxy-1,1,4a,7-tetramethyl-8-oxo-6-vinyltetradecahydrophenanthrene-4,5-diyl dibenzoate
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Product Information
| Product Name | Neoorthosiphol A |
|---|---|
| IUPAC Name | (2S,3S,4R,4aS,4bS,5R,6S,7S,8aR,9R,10aS)-3,9-diacetoxy-2,7,8a-trihydroxy-1,1,4a,7-tetramethyl-8-oxo-6-vinyltetradecahydrophenanthrene-4,5-diyl dibenzoate |
| Molecular Formula | C38H44O12 |
| Molecular Weight | 692.76 |
| SMILES | C[C@@]12[C@@]3([C@@](O)([C@H](OC(C)=O)C[C@]1(C(C)(C)[C@H](O)[C@H](OC(C)=O)[C@@H]2OC(=O)C4=CC=CC=C4)[H])C(=O)[C@@](C)(O)[C@@H](C=C)[C@H]3OC(=O)C5=CC=CC=C5)[H] |
| InChI Key | PBUZGANPVDYQRM-FRZINCLTSA-N |
| Synonym | neoorthosiphol A;1(2H)-Phenanthrenone, 6,10-bis(acetyloxy)-4,5-bis(benzoyloxy)-3-ethenyldodecahydro-2,7,10a-trihydroxy-2,4b,8,8-tetramethyl-, (2S,3S,4R,4aS,4bS,5R,6S,7S,8aS,10R,10aR)- |
| CAS No. | 243448-72-8 |
Synthetic Route by SureRoute
2. ACSNGV258 Molecular Building Block Synthetic Route
Orthosiphol A
Orthosiphol B
(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