Isotheaflavin

cas: 31701-93-6 — see every product listed under this CAS number, including other names

Isotheaflavin (CAS 31701-93-6) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 25mg, 10mg, 50mg. Offered by: GLPBio, Biosynth.

brandGLPBio
catalog numberGC60954-1
cas31701-93-6
size1mg
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Available pack sizes

brand size price
GLPBio 1mg 1256.99 Pln
Biosynth 25mg price on request
Biosynth 10mg price on request
Biosynth 50mg price on request

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

Isotheaflavin is a catechin.

Source: ChEBI

Identity
Molecular formulaC29H24O12
Molecular weight564.5 g/mol
IUPAC name3,4,6-trihydroxy-8-[(2R,3S)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]-1-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]benzo[7]annulen-5-one
InChIKeyIPMYMEWFZKHGAX-XDPYCTQPSA-N
SMILESC1[C@@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC4=C(C(=C(C=C4[C@@H]5[C@@H](CC6=C(C=C(C=C6O5)O)O)O)O)O)C(=O)C(=C3)O)O

Computed by PubChem (NCBI)

Synonyms: Isotheaflavin
Related forms of this compound
3,4,6-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]benzo[7]annulen-5-one C29H24O12
Isomers (same molecular formula)
[(2S,3R,4S,5S)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate C29H24O12

Also listed as

Isotheaflavin, 99.36% MedChemExpress CAS 31701-93-6
ISOTHEAFLAVIN, 99.28% Chemat CAS 31701-93-6