Account Triptonine b
- Catalog No. :
- ACTHTT774
- CAS No. :
- 168009-85-6
- Molecular Formula :
- C46H49NO22
- Molecular Weight :
- 967.88
IUPAC Name:(52R,53R,54R,55S,55aR,56R,57R,58S,59S,59aS,510R,8R)-55a-(acetoxymethyl)-57,8-bis((furan-3-carbonyl)oxy)-59-hydroxy-52,59,8-trimethyl-2,7-dioxo-53,54,55,55a,56,57,58,59-octahydro-52H-3,6-dioxa-1(3,2)-pyridina-5(2,8)-3,9a-methanobenzo[b]oxepinacyclodecaphane-54,55,56,510-tetrayl tetraacetate
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Product Information
| Product Name | Triptonine b |
|---|---|
| IUPAC Name | (52R,53R,54R,55S,55aR,56R,57R,58S,59S,59aS,510R,8R)-55a-(acetoxymethyl)-57,8-bis((furan-3-carbonyl)oxy)-59-hydroxy-52,59,8-trimethyl-2,7-dioxo-53,54,55,55a,56,57,58,59-octahydro-52H-3,6-dioxa-1(3,2)-pyridina-5(2,8)-3,9a-methanobenzo[b]oxepinacyclodecaphane-54,55,56,510-tetrayl tetraacetate |
| MDL No. | MFCD21363958 |
| Molecular Formula | C46H49NO22 |
| Molecular Weight | 967.88 |
| SMILES | CC(=O)OC[C@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3[C@@H](OC(C)=O)[C@@]14O[C@@]3(C)COC(=O)C1=C(CC[C@@](C)(OC(=O)C3=COC=C3)C(=O)O[C@@H]([C@H](OC(=O)C3=COC=C3)[C@@H]2OC(C)=O)[C@]4(C)O)N=CC=C1 |
| InChI Key | RZVUCQZHOKQLFV-NKVWGZNUSA-N |
| Synonym | Triptonine B;18-O-(3-Furoyl)wilfortrine;Triptonine B (Tripterygium wilfordii);Wilfortrine 26-(3-furoate);3-Furancarboxylic acid, 10,13,22,23-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-7,8,9,10,12,13,14,15,17,18,19,20-dodecahydro-21-hydroxy-8,18,21-trimethyl-5,17-dioxo-8,11-epoxy-9,12-ethano-11,15-methano-5H,11H[1,9]dioxacyclooctadecino[4,3-b]pyridine-14,18-diylester, (8R,9R,10R,11S,12R,13R,14R,15S,18R,21S,22S,23R)-;3-Furancarboxylic acid, (8R,9R,10R,11S,12R,13R,14R,15S,18R,21S,22S,23R)-10,13,22,23-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-7,8,9,10,12,13,14,15,17,18,19,20-dodecahydro-21-hydroxy-8,18,21-trimethyl-5,17-dioxo-8,11-epoxy-9,12-ethano-11,15-methano-5H,11H-[1,9]dioxacyclooctadecino[4,3-b]pyridine-14,...;Triptonine B USP/EP/BP;triptonine B/18-O-(3-Furoyl)wilfortrine |
| CAS No. | 168009-85-6 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACTHTT774 Molecular Building Block Synthetic Route
Wilfortrine
(52R,53R,54R,55S,55aR,56R,57R,58S,59S,59aS,510R,8S)-55a-(Acetoxymethyl)-57-((furan-3-carbonyl)oxy)-59-hydroxy-52,59,8-trimethyl-2,7-dioxo-53,54,55,55a,56,57,58,59-octahydro-52H-3,6-dioxa-1(3,2)-pyridina-5(2,8)-3,9a-methanobenzo[b]oxepinacyclodecaphane-54,55,56,510-tetrayl tetraacetate
Euojaponine d