Account LE 28
- Catalog No. :
- ACCYBA564
- CAS No. :
- 1416080-97-1
- Molecular Formula :
- C102H111N10O21S3+
- Molecular Weight :
- 1909.26
IUPAC Name:1-(6-(((S)-4-carboxy-1-((S)-2-(((S)-1-carboxy-4-((4-((3-(1-((2-(3,6-di(indolin-1-yl)xanthylium-9-yl)phenyl)sulfonyl)piperidine-4-carboxamido)propyl)carbamoyl)-2,6-dimethylbenzoyl)oxy)-3-oxobutan-2-yl)carbamoyl)pyrrolidin-1-yl)-1-oxobutan-2-yl)amino)-6-oxohexyl)-2-((1E,3E)-5-((Z)-1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
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Product Information
| Product Name | LE 28 |
|---|---|
| IUPAC Name | 1-(6-(((S)-4-carboxy-1-((S)-2-(((S)-1-carboxy-4-((4-((3-(1-((2-(3,6-di(indolin-1-yl)xanthylium-9-yl)phenyl)sulfonyl)piperidine-4-carboxamido)propyl)carbamoyl)-2,6-dimethylbenzoyl)oxy)-3-oxobutan-2-yl)carbamoyl)pyrrolidin-1-yl)-1-oxobutan-2-yl)amino)-6-oxohexyl)-2-((1E,3E)-5-((Z)-1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate |
| Molecular Formula | C102H111N10O21S3+ |
| Molecular Weight | 1909.26 |
| SMILES | S(=O)(=O)(C1=C(C=2C3=C([O+]=C4C2C=CC(=C4)N5C=6C(CC5)=CC=CC6)C=C(C=C3)N7C=8C(CC7)=CC=CC8)C=CC=C1)N9CCC(C(NCCCNC(=O)C%10=CC(C)=C(C(OCC([C@@H](NC(=O)[C@H]%11N(C([C@@H](NC(CCCCC[N+]=%12C=%13C(C(C)(C)C%12C=CC=CC=C%14N(CC)C=%15C(C%14(C)C)=CC(S(=O)(=O)O)=CC%15)=CC(S(=O)(=O)[O-])=CC%13)=O)CCC(O)=O)=O)CCC%11)CC(O)=O)=O)=O)C(C)=C%10)=O)CC9 |
| InChI Key | NBKLIRAPFKTQDD-IYUQAZOKSA-O |
| Synonym | L-Prolinamide, N-[6-[2-[5-(1-ethyl-1,3-dihydro-3,3-dimethyl-5-sulfo-2H-indol-2-ylidene)-1,3-pentadien-1-yl]-3,3-dimethyl-5-sulfo-3H-indolio]-1-oxohexyl]-L-α-glutamyl-N-[(1S)-3-[[4-[[[3-[[[1-[[2-[3,6-bis(2,3-dihydro-1H-indol-1-yl)xanthylium-9-yl]phenyl]sulfonyl]-4-piperidinyl]carbonyl]amino]propyl]amino]carbonyl]-2,6-dimethylbenzoyl]oxy]-1-(carboxymethyl)-2-oxopropyl]- |
| CAS No. | 1416080-97-1 |
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