Account AY254
- Catalog No. :
- ACVFDH953
- CAS No. :
- 2093408-03-6
- Molecular Formula :
- C30H49N9O6
- Molecular Weight :
- 631.78
IUPAC Name:N-((6S,9S,12S,15S)-1,1-diamino-6-carbamoyl-12,16-dicyclohexyl-9-methyl-8,11,14-trioxo-2,7,10,13-tetraazahexadec-1-en-15-yl)isoxazole-5-carboxamide
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Product Information
| Product Name | AY254 |
|---|---|
| IUPAC Name | N-((6S,9S,12S,15S)-1,1-diamino-6-carbamoyl-12,16-dicyclohexyl-9-methyl-8,11,14-trioxo-2,7,10,13-tetraazahexadec-1-en-15-yl)isoxazole-5-carboxamide |
| Molecular Formula | C30H49N9O6 |
| Molecular Weight | 631.78 |
| SMILES | O=C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N)=O)=O)C)=O)C1CCCCC1)=O)CC2CCCCC2)C3=CC=NO3 |
| InChI Key | ZVDSAIOSGOWYAW-CKLTXHEASA-N |
| Synonym | N-((6S,9S,12S,15S)-1-amino-6-carbamoyl-12,16-dicyclohexyl-1-imino-9-methyl-8,11,14-trioxo-2,7,10,13-tetraazahexadecan-15-yl)isoxazole-5-carboxamide;N-[(2S)-1-[[(1S)-2-[[(2S)-1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-cyclohexyl-2-oxoethyl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide |
| CAS No. | 2093408-03-6 |
Synthetic Route by SureRoute
2. ACVFDH953 Molecular Building Block Synthetic Route
N-((S)-1-(((2S,3S)-1-((3-(4-(Aminomethyl)piperidine-1-carbonyl)benzyl)amino)-3-methyl-1-oxopentan-2-yl)amino)-3-cyclohexyl-1-oxopropan-2-yl)isoxazole-5-carboxamide
N-((2S)-3-Cyclohexyl-1-(((2S)-1-(2,3-dihydrospiro[indene-1,4'-piperidin]-1'-yl)-3-methyl-1-oxopentan-2-yl)amino)-1-oxopropan-2-yl)isoxazole-5-carboxamide
N-((S)-3-Cyclohexyl-1-(((2S,3S)-3-methyl-1-oxo-1-(spiro[indene-1,4'-piperidin]-1'-yl)pentan-2-yl)amino)-1-oxopropan-2-yl)isoxazole-5-carboxamide