Account Ryanodine
- Catalog No. :
- ACIHJP016
- CAS No. :
- 15662-33-6
- Molecular Formula :
- C25H35NO9
- Molecular Weight :
- 493.55
IUPAC Name:(1S,2R,2aS,2a1R,3S,3aS,6S,7R,7aR,9S,9aR)-1,2a,2a1,3a,7,9-hexahydroxy-1-isopropyl-3,6,9a-trimethyldodecahydro-3,9-methanobenzo[1,2]pentaleno[1,6-bc]furan-2-yl 1H-pyrrole-2-carboxylate
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Product Information
| Product Name | Ryanodine |
|---|---|
| IUPAC Name | (1S,2R,2aS,2a1R,3S,3aS,6S,7R,7aR,9S,9aR)-1,2a,2a1,3a,7,9-hexahydroxy-1-isopropyl-3,6,9a-trimethyldodecahydro-3,9-methanobenzo[1,2]pentaleno[1,6-bc]furan-2-yl 1H-pyrrole-2-carboxylate |
| Molecular Formula | C25H35NO9 |
| Molecular Weight | 493.55 |
| SMILES | O[C@@]([C@](O)1[C@@H]2OC(C3=CC=CN3)=O)([C@](C)4[C@](O)2C(C)C)[C@@]5([C@H](O)[C@H]6C)[C@@](CC6)(O)[C@]1(C)C[C@]4(O)O5 |
| InChI Key | JJSYXNQGLHBRRK-SFEDZAPPSA-N |
| Synonym | [(1R,2R,3S,6S,7S,9S,10R,11S,12R,13S,14R)-2,6,9,11,13,14-hexahydroxy-3,7,10-trimethyl-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl] 1H-pyrrole-2-carboxylate | 1H-Pyrrole-2-carboxylic acid, (3S,4R,4aR,6S,7S,8R,8aS,8bR,9S,9aS)-dod |
| CAS No. | 15662-33-6 |
| PubChem CID | 11317883 |
Synthetic Route by SureRoute
2. ACIHJP016 Molecular Building Block Synthetic Route
(5a-((3-(benzoyloxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-2-hydroxy-5-methyltetrahydro-1H-3,4-dioxa-2,5-methanocyclobuta[cd]pentalen-1a1(3aH)-yl)methyl benzoate
Benzoylpaeoniflorin
((1aR,1a1S,2R,3aR,5S,5aR)-2,5a-dihydroxy-5-methyltetrahydro-1H-3,4-dioxa-2,5-methanocyclobuta[cd]pentalen-1a1(3aH)-yl)methyl benzoate