Account NHS Ester-PEG4-Val-Ala-PBD
- Catalog No. :
- ACDEJS331
- CAS No. :
- -
- Molecular Formula :
- C66H76N8O18
- Molecular Weight :
- 1269.37
IUPAC Name:2,5-dioxopyrrolidin-1-yl (2R,5R)-5-isopropyl-1-((4-((S)-7-methoxy-8-(3-(((S)-7-methoxy-2-(4-methoxyphenyl)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)propoxy)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-2-yl)phenyl)amino)-2-methyl-1,4,7-trioxo-10,13,16,19-tetraoxa-3,6-diazadocosan-22-oate
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Product Information
| Product Name | NHS Ester-PEG4-Val-Ala-PBD |
|---|---|
| IUPAC Name | 2,5-dioxopyrrolidin-1-yl (2R,5R)-5-isopropyl-1-((4-((S)-7-methoxy-8-(3-(((S)-7-methoxy-2-(4-methoxyphenyl)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)propoxy)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-2-yl)phenyl)amino)-2-methyl-1,4,7-trioxo-10,13,16,19-tetraoxa-3,6-diazadocosan-22-oate |
| Molecular Formula | C66H76N8O18 |
| Molecular Weight | 1269.37 |
| SMILES | O=C([C@@H](C)NC([C@@H](C(C)C)NC(CCOCCOCCOCCOCCC(ON1C(CCC1=O)=O)=O)=O)=O)NC2=CC=C(C=C2)C3=CN4C(C5=CC(OC)=C(C=C5N=C[C@]4([H])C3)OCCCOC6=C(C=C7C(N8[C@@](C=NC7=C6)([H])CC(C(C=C9)=CC=C9OC)=C8)=O)OC)=O |
| InChI Key | ULBDKSIWAYKCQR-LIVRBHPVSA-N |
Synthetic Route by SureRoute
2. ACDEJS331 Molecular Building Block Synthetic Route
Mal-PEG4-VA-PBD
6-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-((S)-1-(((S)-1-((4-((S)-7-methoxy-8-(3-(((S)-7-methoxy-2-(4-methoxyphenyl)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)propoxy)-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-2-yl)phenyl)amino)-1-oxopropan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)hexanamide
mc-vc-PAB-PBD