V1-iridoid

cas: 87441-71-2 — see every product listed under this CAS number, including other names

V1-iridoid (CAS 87441-71-2) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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Structural formula: {0} (CAS {1})

[(4S,7S,8S,11S)-2-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[5.3.1.04,11]undeca-1(10),5-dien-6-yl]methyl 3-(4-hydroxyphenyl)propanoate (CAS 87441-71-2) is a chemical compound with the molecular formula C25H28O12 and a molecular weight of 520.5 g/mol. IUPAC name: [(4S,7S,8S,11S)-2-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[5.3.1.04,11]undeca-1(10),5-dien-6-yl]methyl 3-(4-hydroxyphenyl)propanoate. InChIKey: UNMSAFXENBIZSU-GOXDRFODSA-N.

Identity
Molecular formulaC25H28O12
Molecular weight520.5 g/mol
IUPAC name[(4S,7S,8S,11S)-2-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[5.3.1.04,11]undeca-1(10),5-dien-6-yl]methyl 3-(4-hydroxyphenyl)propanoate
InChIKeyUNMSAFXENBIZSU-GOXDRFODSA-N
SMILESC1=CC(=CC=C1CCC(=O)OCC2=C[C@H]3[C@H]4[C@@H]2[C@@H](OC=C4C(=O)O3)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: V1 iridoid, orb1992536

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