Account MC-Gly-Gly-Phe-Gly-(S)-Cyclopropane-Exatecan
- Catalog No. :
- ACQIIE773
- CAS No. :
- 2414254-52-5
- Molecular Formula :
- C55H60FN9O13
- Molecular Weight :
- 1074.13
IUPAC Name:N-((2S,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-(S)-Cyclopropane-Exatecan |
|---|---|
| IUPAC Name | N-((2S,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 | O=C(NCC(NCC(N[C@@H](CC1=CC=CC=C1)C(NCC(NCO[C@@H](C2CC2)C(N[C@H]3CCC4=C5C3=C(CN6C(C(COC([C@@]7(CC)O)=O)=C7C=C68)=O)C8=NC5=CC(F)=C4C)=O)=O)=O)=O)=O)CCCCCN9C(C=CC9=O)=O |
| InChI Key | WKCCHLIWLNJSMH-DVXRIDOZSA-N |
| Synonym | MC-Gly-Gly-Phe-Gly-(S)-Cyclopropane-Exatecan |
| CAS No. | 2414254-52-5 |
Synthetic Route by SureRoute
2. ACQIIE773 Molecular Building Block Synthetic Route
MC-Gly-Gly-Phe-Gly-(R)-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