Products 39712-18-0
CAS 39712-18-0 is the registry number for 4-O-Methyldebenzoylpaeoniflorin. Offered by: MedChemExpress. Available pack sizes: Get quote.
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1R,2S,3R,5R,6R,8S)-2-(hydroxymethyl)-6-methoxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]oxane-3,4,5-triol (CAS 39712-18-0) is a chemical compound with the molecular formula C17H26O10 and a molecular weight of 390.4 g/mol. IUPAC name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1R,2S,3R,5R,6R,8S)-2-(hydroxymethyl)-6-methoxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]oxane-3,4,5-triol. InChIKey: MSPXCTHETPQCIC-BMZPKHAFSA-N.
| Molecular formula | C17H26O10 |
|---|---|
| Molecular weight | 390.4 g/mol |
| IUPAC name | (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1R,2S,3R,5R,6R,8S)-2-(hydroxymethyl)-6-methoxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]oxane-3,4,5-triol |
| InChIKey | MSPXCTHETPQCIC-BMZPKHAFSA-N |
| SMILES | C[C@]12C[C@@]3([C@@H]4C[C@]1([C@@]4([C@H](O2)O3)CO)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)OC |
Computed by PubChem (NCBI)
Synonyms:
4-O-Methyldebenzoylpaeoniflorin, orb1941461