Account RAS/RAS-RAF-IN-1
- Catalog No. :
- ACEIXD363
- CAS No. :
- 2447039-81-6
- Molecular Formula :
- C45H57N7O7
- Molecular Weight :
- 807.99
IUPAC Name:(3S)-1-acryloyl-N-((2S)-1-(((63S,4S)-13-(2-cyanopropan-2-yl)-25-hydroxy-10,10-dimethyl-5,7-dioxo-61,62,63,64,65,66-hexahydro-11H-8-oxa-1(6,1)-indola-6(1,3)-pyridazina-2(1,3)-benzenacycloundecaphane-4-yl)amino)-3-methyl-1-oxobutan-2-yl)-N-methylpyrrolidine-3-carboxamide
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Product Information
| Product Name | RAS/RAS-RAF-IN-1 |
|---|---|
| IUPAC Name | (3S)-1-acryloyl-N-((2S)-1-(((63S,4S)-13-(2-cyanopropan-2-yl)-25-hydroxy-10,10-dimethyl-5,7-dioxo-61,62,63,64,65,66-hexahydro-11H-8-oxa-1(6,1)-indola-6(1,3)-pyridazina-2(1,3)-benzenacycloundecaphane-4-yl)amino)-3-methyl-1-oxobutan-2-yl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Formula | C45H57N7O7 |
| Molecular Weight | 807.99 |
| SMILES | CC([C@@H](C(N[C@H]1CC2=CC(O)=CC(C3=CC=C4C(N(C=C4C(C)(C#N)C)CC(C)(COC([C@@H]5CCCN(C1=O)N5)=O)C)=C3)=C2)=O)N(C([C@H]6CCN(C(C=C)=O)C6)=O)C)C |
| InChI Key | RCXSKUOUWMZVFF-NXCZKTMTSA-N |
| Synonym | RAS/RAS-RAF-IN-1 |
| CAS No. | 2447039-81-6 |
Synthetic Route by SureRoute
2. ACEIXD363 Molecular Building Block Synthetic Route
N-(1-((11-Ethyl-12-(2-(1-methoxyethyl)pyridin-3-yl)-10,10-dimethyl-5,7-dioxo-61,62,63,64,65,66-hexahydro-11H-8-oxa-1(5,3)-indola-6(1,3)-pyridazina-2(1,3)-benzenacycloundecaphane-4-yl)amino)-3-methyl-1-oxobutan-2-yl)-N-methyl-1-(4-morpholinobut-2-ynoyl)pyrrolidine-3-carboxamide
(αS,5S)-7-[4-(Dimethylamino)-4-methyl-1-oxo-2-pentyn-1-yl]-N-[(3R,9S,15S)-2-ethyl-2,4,5,6,9,10,11,12,15,16-decahydro-3-[2-[(1S)-1-methoxyethyl]-3-pyridinyl]-5,5-dimethyl-8,14-dioxo-8H,14H-1,22-etheno-9,13-imino-17,21-methenopyrrolo[3,4-r][1,7]oxaazacyclodocosin-15-yl]-α-(1-methylethyl)-1-oxo-2,7-diazaspiro[4.4]nonane-2-acetamide
KRAS G12C inhibitor 58