Account Acid-PEG4-Val-Cit-PAB-MMAE
- Catalog No. :
- ACUUMO980
- CAS No. :
- -
- Molecular Formula :
- C70H114N10O19
- Molecular Weight :
- 1399.73
IUPAC Name:(6S,9S)-1-amino-6-((4-((5S,11S,12R)-11-((S)-sec-butyl)-12-(2-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-2-oxoethyl)-5,8-diisopropyl-4,10-dimethyl-3,6,9-trioxo-2,13-dioxa-4,7,10-triazatetradecyl)phenyl)carbamoyl)-9-isopropyl-1,8,11-trioxo-14,17,20,23-tetraoxa-2,7,10-triazahexacosan-26-oic acid
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Product Information
| Product Name | Acid-PEG4-Val-Cit-PAB-MMAE |
|---|---|
| IUPAC Name | (6S,9S)-1-amino-6-((4-((5S,11S,12R)-11-((S)-sec-butyl)-12-(2-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-2-oxoethyl)-5,8-diisopropyl-4,10-dimethyl-3,6,9-trioxo-2,13-dioxa-4,7,10-triazatetradecyl)phenyl)carbamoyl)-9-isopropyl-1,8,11-trioxo-14,17,20,23-tetraoxa-2,7,10-triazahexacosan-26-oic acid |
| Molecular Formula | C70H114N10O19 |
| Molecular Weight | 1399.73 |
| SMILES | O=C(O)CCOCCOCCOCCOCCC(N[C@@H](C(C)C)C(N[C@@H](CCCNC(N)=O)C(NC1=CC=C(C=C1)COC(N(C)[C@@H](C(C)C)C(NC(C(C)C)C(N(C)[C@@H]([C@H](CC)C)[C@@H](CC(N2[C@H]([C@@H]([C@H](C(N[C@@H]([C@H](C3=CC=CC=C3)O)C)=O)C)OC)CCC2)=O)OC)=O)=O)=O)=O)=O)=O |
| InChI Key | ZPDLKEANMIPJSY-ICBMQJAOSA-N |
Synthetic Route by SureRoute
2. ACUUMO980 Molecular Building Block Synthetic Route
Amino-PEG4-Val-Cit-PAB-MMAE
4-((17S,20S)-1-Azido-17-isopropyl-15,18-dioxo-20-(3-ureidopropyl)-3,6,9,12-tetraoxa-16,19-diazahenicosan-21-amido)benzyl ((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate
4-((S)-2-((S)-2-Amino-3-methylbutanamido)-5-ureidopentanamido)benzyl ((S)-1-(((S)-1-(((3R,4S,5S)-1-((S)-2-((1R,2R)-3-(((1S,2R)-1-hydroxy-1-phenylpropan-2-yl)amino)-1-methoxy-2-methyl-3-oxopropyl)pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl)(methyl)amino)-3-methyl-1-oxobutan-2-yl)amino)-3-methyl-1-oxobutan-2-yl)(methyl)carbamate