Account Duocarmycin GA
- Catalog No. :
- ACAWBW259
- CAS No. :
- 1613286-59-1
- Molecular Formula :
- C26H25ClN4O3
- Molecular Weight :
- 476.96
IUPAC Name:(S)-N-(2-(1-(chloromethyl)-5-hydroxy-2,3-dihydro-1H-benzo[e]indole-3-carbonyl)-1H-indol-6-yl)-2-(dimethylamino)acetamide
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Product Information
| Product Name | Duocarmycin GA |
|---|---|
| IUPAC Name | (S)-N-(2-(1-(chloromethyl)-5-hydroxy-2,3-dihydro-1H-benzo[e]indole-3-carbonyl)-1H-indol-6-yl)-2-(dimethylamino)acetamide |
| Molecular Formula | C26H25ClN4O3 |
| Molecular Weight | 476.96 |
| SMILES | O=C(NC1=CC2=C(C=C1)C=C(C(N3C[C@@H](CCl)C4=C3C=C(O)C5=CC=CC=C45)=O)N2)CN(C)C |
| InChI Key | KIRMXYXWPGUZLM-MRXNPFEDSA-N |
| Synonym | DuocarMycin GA;CS-1382;Acetamide, N-[2-[[(1S)-1-(chloromethyl)-1,2-dihydro-5-hydroxy-3H-benz[e]indol-3-yl]carbonyl]-1H-indol-6-yl]-2-(dimethylamino)- |
| CAS No. | 1613286-59-1 |
Synthetic Route by SureRoute
2. ACAWBW259 Molecular Building Block Synthetic Route
(S)-5-Amino-N-(2-(1-(chloromethyl)-5-hydroxy-2,3-dihydro-1H-benzo[e]indole-3-carbonyl)-1H-indol-5-yl)-1H-indole-2-carboxamide
DC1
(S)-N-(2-(1-(Chloromethyl)-5-hydroxy-2,3-dihydro-1H-benzo[e]indole-3-carbonyl)-1H-indol-5-yl)-5-(3-(methyldisulfanyl)propanamido)-1H-indole-2-carboxamide