Account P5(PEG24)-VC-PAB-exatecan
- Catalog No. :
- ACMHHN455
- CAS No. :
- 2928571-43-9
- Molecular Formula :
- C100H151FN9O36P
- Molecular Weight :
- 2105.31
IUPAC Name:4-((2S)-2-((2S)-2-(4-((ethynyl((71-hydroxy-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69-tricosaoxahenheptacontyl)oxy)phosphoryl)amino)benzamido)-3-methylbutanamido)-5-ureidopentanamido)benzyl ((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)carbamate
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Product Information
| Product Name | P5(PEG24)-VC-PAB-exatecan |
|---|---|
| IUPAC Name | 4-((2S)-2-((2S)-2-(4-((ethynyl((71-hydroxy-3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69-tricosaoxahenheptacontyl)oxy)phosphoryl)amino)benzamido)-3-methylbutanamido)-5-ureidopentanamido)benzyl ((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)carbamate |
| Molecular Formula | C100H151FN9O36P |
| Molecular Weight | 2105.31 |
| SMILES | O=C(C1=CC=C(C=C1)NP(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)(C#C)=O)N[C@@H](C(C)C)C(N[C@@H](CCCNC(N)=O)C(NC(C=C2)=CC=C2COC(N[C@@H]3C4=C5C(C(N6C5)=CC([C@](O)(C(OC7)=O)CC)=C7C6=O)=NC8=CC(F)=C(C)C(CC3)=C84)=O)=O)=O |
| InChI Key | KZEPGSKCAWPFGG-HTZDUXJFSA-N |
| Synonym | P5(PEG24)-VC-PAB-exatecan |
| CAS No. | 2928571-43-9 |
Synthetic Route by SureRoute
2. ACMHHN455 Molecular Building Block Synthetic Route
4-((S)-2-((S)-2-amino-3-methylbutanamido)-5-ureidopentanamido)benzyl ((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)carbamate
4-((S)-2-((S)-2-(6-aminohexanamido)-3-methylbutanamido)-5-ureidopentanamido)benzyl ((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)carbamate
Cyclooctyne-O-amido-PEG4-VC-PAB-Gly-Gly-NH-O-CO-Exatecan