Account SCY-078 citrate
- Catalog No. :
- ACXVIN071
- CAS No. :
- 1965291-08-0
- Molecular Formula :
- C50H75N5O11
- Molecular Weight :
- 922.17
IUPAC Name:(1S,2R,3R,4aR,6aS,7R,8R,10aR,10bR,12aR)-2-((R)-2-amino-2,3,3-trimethylbutoxy)-1,6a,8,10a-tetramethyl-8-((R)-3-methylbutan-2-yl)-3-(5-(pyridin-4-yl)-1H-1,2,4-triazol-1-yl)-1,3,4,6,6a,7,8,9,10,10a,10b,11,12,12a-tetradecahydro-2H-1,4a-(methanooxymethano)chrysene-7-carboxylic acid--2-hydroxypropane-1,2,3-tricarboxylic acid (1/1)
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Product Information
| Product Name | SCY-078 citrate |
|---|---|
| IUPAC Name | (1S,2R,3R,4aR,6aS,7R,8R,10aR,10bR,12aR)-2-((R)-2-amino-2,3,3-trimethylbutoxy)-1,6a,8,10a-tetramethyl-8-((R)-3-methylbutan-2-yl)-3-(5-(pyridin-4-yl)-1H-1,2,4-triazol-1-yl)-1,3,4,6,6a,7,8,9,10,10a,10b,11,12,12a-tetradecahydro-2H-1,4a-(methanooxymethano)chrysene-7-carboxylic acid--2-hydroxypropane-1,2,3-tricarboxylic acid (1/1) |
| Molecular Formula | C50H75N5O11 |
| Molecular Weight | 922.17 |
| SMILES | C(CC(O)=O)(CC(O)=O)(C(O)=O)O.C[C@@]12[C@]3([C@@](C=4[C@@]([C@]5(C)[C@@](C)(CC4)[C@H](C(O)=O)[C@]([C@@H](C(C)C)C)(C)CC5)(CC3)[H])(C[C@H]([C@@H]1OC[C@](C(C)(C)C)(C)N)N6C(=NC=N6)C=7C=CN=CC7)COC2)[H] |
| InChI Key | WKIRTJACGBEXBZ-FQGZCCSZSA-N |
| Synonym | Ibrexafungerp citrate | GLXC-26020 | Ibrexafungerp citrate [USAN] | brexafemme | D11545 | 4H-1,4A-PROPANO-2H-PHENANTHRO(1,2-C)PYRAN-7-CARBOXYLIC ACID, 15-((2R)-2-AMINO-2,3,3-TRIMETHYLBUTOXY)-8-((1R)-1,2-DIMETHYLPROPYL)-1,6,6A,7,8,9,10,10A,10B,11,12,12A-DO |
| CAS No. | 1965291-08-0 |
| PubChem CID | 137552087 |
Synthetic Route by SureRoute
2. ACXVIN071 Molecular Building Block Synthetic Route
(1S,2R,3R,4aR,6aS,7R,8R,10aR,10bR,12aR)-2-((R)-2-amino-2,3,3-trimethylbutoxy)-1,6a,8,10a-tetramethyl-8-((R)-3-methylbutan-2-yl)-3-(5-(pyridin-4-yl)-1H-1,2,4-triazol-1-yl)-1,3,4,6,6a,7,8,9,10,10a,10b,11,12,12a-tetradecahydro-2H-1,4a-(methanooxymethano)chrysene-7-carboxylic acid
RMC-4529
RMC-4627