Products 128201-92-3
CAS 128201-92-3 is the registry number for IST-622. Offered by: MedChemExpress. Available pack sizes: Get quote.
[3-[[(2R,3aS,4R,6S,7R,7aS)-7-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methyl-2-phenyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-15-methyl-10,17-dioxo-11,18-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,8,12(20),13,15-octaen-8-yl] 3-hydroxypropanoate (CAS 128201-92-3) is a chemical compound with the molecular formula C42H40O16 and a molecular weight of 800.8 g/mol. IUPAC name: [3-[[(2R,3aS,4R,6S,7R,7aS)-7-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methyl-2-phenyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-15-methyl-10,17-dioxo-11,18-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,8,12(20),13,15-octaen-8-yl] 3-hydroxypropanoate. InChIKey: KZEJHRUYDQACMK-AQIWENHBSA-N.
| Molecular formula | C42H40O16 |
|---|---|
| Molecular weight | 800.8 g/mol |
| IUPAC name | [3-[[(2R,3aS,4R,6S,7R,7aS)-7-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methyl-2-phenyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-15-methyl-10,17-dioxo-11,18-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,8,12(20),13,15-octaen-8-yl] 3-hydroxypropanoate |
| InChIKey | KZEJHRUYDQACMK-AQIWENHBSA-N |
| SMILES | C[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]3[C@H]([C@H](O[C@H]2OC4=CC=CC5=C4C6=C7C8=C(C=CC(=C8C(=O)O6)C)OC(=O)C7=C5OC(=O)CCO)C)O[C@H](O3)C9=CC=CC=C9)O)OC)O |
Computed by PubChem (NCBI)