Account MAC glucuronide phenol-linked SN-38
- Catalog No. :
- ACBETO322
- CAS No. :
- 2246380-69-6
- Molecular Formula :
- C50H54N6O20S
- Molecular Weight :
- 1091.07
IUPAC Name:(2S,3S,4S,5R,6S)-6-(4-(((((((S)-4,11-diethyl-4-hydroxy-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl)oxy)methyl)(2-(methylsulfonyl)ethyl)carbamoyl)oxy)methyl)-2-(2-(3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-methylpropanamido)acetamido)phenoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
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Product Information
| Product Name | MAC glucuronide phenol-linked SN-38 |
|---|---|
| IUPAC Name | (2S,3S,4S,5R,6S)-6-(4-(((((((S)-4,11-diethyl-4-hydroxy-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl)oxy)methyl)(2-(methylsulfonyl)ethyl)carbamoyl)oxy)methyl)-2-(2-(3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-methylpropanamido)acetamido)phenoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid |
| MDL No. | 0 |
| Molecular Formula | C50H54N6O20S |
| Molecular Weight | 1091.07 |
| SMILES | C(C)C1=C2C(C=3N(C2)C(=O)C4=C(C3)[C@](CC)(O)C(=O)OC4)=NC=5C1=CC(OCN(C(OCC6=CC(NC(CN(C(CCN7C(=O)C=CC7=O)=O)C)=O)=C(O[C@@H]8O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]8O)C=C6)=O)CCS(C)(=O)=O)=CC5 |
| InChI Key | IKQSTTAUHYHYCV-GVAVQZEZSA-N |
| Synonym | MAC glucuronide phenol-linked SN-38;β-D-Glucopyranosiduronic acid, 4-[[[[[[[(4S)-4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano[3′,4′:6,7]indolizino[1,2-b]quinolin-9-yl]oxy]methyl][2-(methylsulfonyl)ethyl]amino]carbonyl]oxy]methyl]-2-[[2-[[3-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxopropyl]methylamino]acetyl]amino]phenyl;(2S,3S,4S,5R,6S)-6-[4-[[[[[[(S)-4,11-Diethyl-4-hydroxy-3,14-dioxo-3,4,12,14-tetrahydro-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinolin-9-yl]oxy]methyl][2-(methylsulfonyl)ethyl]carbamoyl]oxy]methyl]-2-[2-[3-(2,5-dioxo-2,5-dihydro-1-pyrrolyl)-N-methylpropanamido]acetamido]phenoxy]-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic Acid |
| CAS No. | 2246380-69-6 |
| PubChem CID | 156588615 |
Synthetic Route by SureRoute
2. ACBETO322 Molecular Building Block Synthetic Route
MAC glucuronide α-hydroxy lactone-linked SN-38
Mal-Gly-PAB-Exatecan-D-glucuronic acid
ACDNEY033