Aspecioside

cas: 101915-75-7 — see every product listed under this CAS number, including other names

Aspecioside (CAS 101915-75-7) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-N15330-Get quote
cas101915-75-7
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Structural formula: {0} (CAS {1})

Aspecioside is a cardenolide glycoside.

Source: ChEBI

Identity
Molecular formulaC29H42O10
Molecular weight550.6 g/mol
IUPAC name3-[(1R,3S,5R,7S,10S,11R,13R,14S,15R,18R)-13,18-dihydroxy-10,14-dimethyl-7-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadecan-15-yl]-2H-furan-5-one
InChIKeyBEDAFJYDKDOALK-FHLCUQDTSA-N
SMILESC[C@@H]1[C@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@H](C2)C[C@H]4[C@@]5([C@@H]3C[C@H]([C@]6([C@@]5(CC[C@@H]6C7=CC(=O)OC7)O)C)O)O4)C)O)O)O

Computed by PubChem (NCBI)

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