Account (1α,6β,7α,14R)-1,5,6,14-Tetrahydroxy-4,4-dimethyl-8-methylenedecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-7(8H)-one
- Catalog No. :
- ACMDTU104
- CAS No. :
- 28957-04-2
- Molecular Formula :
- C20H28O6
- Molecular Weight :
- 364.44
IUPAC Name:(1R,5S,6S,6aR,9S,11aS,11bS)-1,5,6,14-tetrahydroxy-4,4-dimethyl-8-methylenedecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-7(8H)-one
![(1α,6β,7α,14R)-1,5,6,14-Tetrahydroxy-4,4-dimethyl-8-methylenedecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-7(8H)-one structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (1α,6β,7α,14R)-1,5,6,14-Tetrahydroxy-4,4-dimethyl-8-methylenedecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-7(8H)-one |
|---|---|
| IUPAC Name | (1R,5S,6S,6aR,9S,11aS,11bS)-1,5,6,14-tetrahydroxy-4,4-dimethyl-8-methylenedecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-7(8H)-one |
| MDL No. | MFCD00221762 |
| Molecular Formula | C20H28O6 |
| Molecular Weight | 364.44 |
| SMILES | C=C1C(=O)[C@]23C(O)[C@H]1CC[C@H]2[C@@]12CO[C@]3(O)[C@@H](O)C1C(C)(C)CC[C@H]2O |
| InChI Key | SDHTXBWLVGWJFT-VQIRHISNSA-N |
| Synonym | ORIDONIN [INCI] | NSC-250682; Isodonol | Rubescenin | DTXSID201021760 | KAUR-16-EN-15-ONE, 7,20-EPOXY-1,6,7,14-TETRAHYDROXY-, (1.ALPHA.,6.BETA.,7.ALPHA.,14R)- | CHEBI:138236 | 0APJ98UCLQ | Oridonin | UNII-0APJ98UCLQ | CS-0007086 | H10339 | NSC 250682 | Cu |
| CAS No. | 28957-04-2 |
| PubChem CID | 5321010 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302
- Precautionary Statement(s)
- P280-P305+P351+P338
Synthetic Route by SureRoute
2. ACMDTU104 Molecular Building Block Synthetic Route
((1R,4R,4aR,5S,6R,6aR,9S,11aS,11bS,14R)-1,5,6,14-tetrahydroxy-4-methyl-8-methylene-7-oxododecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-4-yl)methyl acetate
1,5,6,12,14-pentahydroxy-4,4-dimethyl-8-methylenedecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-7(8H)-one
(1S,4aR,5S,6S,6aR,9S,11aS,11bS,14R)-5,6,14-Trihydroxy-4,4-dimethyl-8-methylene-7-oxododecahydro-1H-6,11b-(epoxymethano)-6a,9-methanocyclohepta[a]naphthalen-1-yl acetate