Account MC-Gly-Gly-Phe-Gly-(R)-Cyclopropane-Exatecan
- Catalog No. :
- ACSYIP230
- CAS No. :
- 2414254-51-4
- Molecular Formula :
- C55H60FN9O13
- Molecular Weight :
- 1074.13
IUPAC Name:N-((2R,10S)-10-benzyl-2-cyclopropyl-1-(((1S,9S)-9-ethyl-5-fluoro-9-hydroxy-4-methyl-10,13-dioxo-2,3,9,10,13,15-hexahydro-1H,12H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinolin-1-yl)amino)-1,6,9,12,15-pentaoxo-3-oxa-5,8,11,14-tetraazahexadecan-16-yl)-6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamide
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Product Information
| Product Name | MC-Gly-Gly-Phe-Gly-(R)-Cyclopropane-Exatecan |
|---|---|
| IUPAC Name | N-((2R,10S)-10-benzyl-2-cyclopropyl-1-(((1S,9S)-9-ethyl-5-fluoro-9-hydroxy-4-methyl-10,13-dioxo-2,3,9,10,13,15-hexahydro-1H,12H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinolin-1-yl)amino)-1,6,9,12,15-pentaoxo-3-oxa-5,8,11,14-tetraazahexadecan-16-yl)-6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamide |
| Molecular Formula | C55H60FN9O13 |
| Molecular Weight | 1074.13 |
| SMILES | N(C([C@H](OCNC(CNC([C@H](CC1=CC=CC=C1)NC(CNC(CNC(CCCCCN2C(=O)C=CC2=O)=O)=O)=O)=O)=O)C3CC3)=O)[C@@H]4C5=C6C(C=7N(C6)C(=O)C8=C(C7)[C@](CC)(O)C(=O)OC8)=NC=9C5=C(CC4)C(C)=C(F)C9 |
| InChI Key | WKCCHLIWLNJSMH-ZDPDOTMZSA-N |
| Synonym | MC-Gly-Gly-Phe-Gly-(R)-Cyclopropane-Exatecan;Glycinamide, N-[6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxohexyl]glycylglycyl-L-phenylalanyl-N-[[(1R)-1-cyclopropyl-2-[[(1S,9S)-9-ethyl-5-fluoro-2,3,9,10,13,15-hexahydro-9-hydroxy-4-methyl-10,13-dioxo-1H,12H-benzo[de]pyrano[3′,4′:6,7]indolizino[1,2-b]quinolin-1-yl]amino]-2-oxoethoxy]methyl]- |
| CAS No. | 2414254-51-4 |
Synthetic Route by SureRoute
2. ACSYIP230 Molecular Building Block Synthetic Route
MC-Gly-Gly-Phe-Gly-(S)-Cyclopropane-Exatecan
Gly-Mal-Gly-Gly-Phe-Gly-amide-methylcyclopropane-Exatecan
1-(((S)-7-Benzyl-20-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-3,6,9,12,15-pentaoxo-2,5,8,11,14-pentaazaicosyl)oxy)-N-((1S,9S)-9-ethyl-5-fluoro-9-hydroxy-4-methyl-10,13-dioxo-2,3,9,10,13,15-hexahydro-1H,12H-benzo[de]pyrano[3',4':6,7]indolizino[1,2-b]quinolin-1-yl)cyclopropane-1-carboxamide