Account SG3400 delate(Mal-amido-PEG8)
- Catalog No. :
- ACOCAS094
- CAS No. :
- 2125685-22-3
- Molecular Formula :
- C55H65N7O16
- Molecular Weight :
- 1080.16
IUPAC Name:allyl (11S,11aS)-8-(3-(((11S,11aS)-10-(((4-((S)-2-((S)-2-(((allyloxy)carbonyl)amino)-3-methylbutanamido)propanamido)benzyl)oxy)carbonyl)-11-hydroxy-7-methoxy-2-methylene-5-oxo-2,3,5,10,11,11a-hexahydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)propoxy)-11-hydroxy-7-methoxy-2-methylene-5-oxo-2,3,11,11a-tetrahydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-10(5H)-carboxylate
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Product Information
| Product Name | SG3400 delate(Mal-amido-PEG8) |
|---|---|
| IUPAC Name | allyl (11S,11aS)-8-(3-(((11S,11aS)-10-(((4-((S)-2-((S)-2-(((allyloxy)carbonyl)amino)-3-methylbutanamido)propanamido)benzyl)oxy)carbonyl)-11-hydroxy-7-methoxy-2-methylene-5-oxo-2,3,5,10,11,11a-hexahydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)propoxy)-11-hydroxy-7-methoxy-2-methylene-5-oxo-2,3,11,11a-tetrahydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-10(5H)-carboxylate |
| Molecular Formula | C55H65N7O16 |
| Molecular Weight | 1080.16 |
| SMILES | O=C(N(C1=CC(OCCCOC2=C(OC)C=C3C(N(C(OCC4=CC=C(NC([C@@H](NC([C@@H](NC(OCC=C)=O)C(C)C)=O)C)=O)C=C4)=O)[C@@H](O)[C@@](CC(C5)=C)([H])N5C3=O)=C2)=C(OC)C=C16)[C@@H](O)[C@@](CC(C7)=C)([H])N7C6=O)OCC=C |
| InChI Key | ZNCBIKZLGJADID-NIOYSHGBSA-N |
| Synonym | SG3400 delate(Mal-amido-PEG8) |
| CAS No. | 2125685-22-3 |
Synthetic Route by SureRoute
2. ACOCAS094 Molecular Building Block Synthetic Route
Allyl (11S,11aS)-8-((5-(((11S,11aS)-10-(((4-((S)-2-((S)-2-(((allyloxy)carbonyl)amino)-3-methylbutanamido)propanamido)benzyl)oxy)carbonyl)-11-hydroxy-7-methoxy-2-methyl-5-oxo-5,10,11,11a-tetrahydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)pentyl)oxy)-11-hydroxy-7-methoxy-2-methyl-5-oxo-11,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-10(5H)-carboxylate
(11S,11aS)-4-((S)-2-((S)-2-Amino-3-methylbutanamido)propanamido)benzyl 11-hydroxy-7-methoxy-8-((5-(((S)-7-methoxy-2-methyl-5-oxo-5,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-8-yl)oxy)pentyl)oxy)-2-methyl-5-oxo-11,11a-dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-10(5H)-carboxylate
Tesirine intermediate-2