Products 165338-27-2

CAS 165338-27-2 is the registry number for Hemiphroside A. Offered by: Biosynth, Chemat, MedChemExpress. Available pack sizes: 10mg, 5mg, 25mg, 50mg, Get quote.

Hemiphroside A
Biosynth, Chemat, MedChemExpress
  • size: 10mg, 5mg, 25mg, 50mg
  • Variants: 6
from 2790.80
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Structural formula: {0} (CAS {1})

[5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate (CAS 165338-27-2) is a chemical compound with the molecular formula C31H40O16 and a molecular weight of 668.6 g/mol. IUPAC name: [5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate. InChIKey: VKUXVDUAEAQCSK-UHFFFAOYSA-N.

Identity
Molecular formulaC31H40O16
Molecular weight668.6 g/mol
IUPAC name[5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
InChIKeyVKUXVDUAEAQCSK-UHFFFAOYSA-N
SMILESCOC1=C(C=C(C=C1)CCOC2C(C(C(C(O2)CO)OC(=O)C=CC3=CC(=C(C=C3)O)OC)OC4C(C(C(C(O4)CO)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Hemiphroside A
Isomers (same molecular formula)
(1R,2S,3R,6R,8S,9S,13S,14R,15R,16S,17R)-15,16-dihydroxy-9,13-dimethyl-3-(3-methylbut-2-enoyloxy)-4,10-dioxo-11-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,18-dioxapentacyclo[12.5.0.01,6.02,17.08,13]nonadec-11-ene-17-carboxylic acid C31H40O16