Products 196961-44-1

CAS 196961-44-1 is the registry number for 3-[4-Methoxy-3-(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-2-naphthalenyl)phenyl]-2-propenoic acid, 95%. Offered by: Chemat. Available pack sizes: 100mg, 250mg, 1g.

3-[4-Methoxy-3-(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-2-naphthalenyl)phenyl]-2-propenoic acid, 95%
Chemat
  • size: 100mg, 250mg, 1g
  • Variants: 3
from 1302.80
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Structural formula: {0} (CAS {1})

3-[4-methoxy-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)phenyl]prop-2-enoic acid (CAS 196961-44-1) is a chemical compound with the molecular formula C25H30O3 and a molecular weight of 378.5 g/mol. IUPAC name: 3-[4-methoxy-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)phenyl]prop-2-enoic acid. InChIKey: OXEWZWAZSQUGLS-UHFFFAOYSA-N.

Identity
Molecular formulaC25H30O3
Molecular weight378.5 g/mol
IUPAC name3-[4-methoxy-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)phenyl]prop-2-enoic acid
InChIKeyOXEWZWAZSQUGLS-UHFFFAOYSA-N
SMILESCC1=CC2=C(C=C1C3=C(C=CC(=C3)C=CC(=O)O)OC)C(CCC2(C)C)(C)C

Computed by PubChem (NCBI)

Isomers (same molecular formula)
(8R,9S,13S,14S,16R,17R)-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-16,17-diol C25H30O3
(8R,9S,13S,14S,16R,17S)-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-16,17-diol C25H30O3
(8R,9S,13S,14S,16S,17R)-13-methyl-3-phenylmethoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-16,17-diol C25H30O3
[(8R,9S,10R,13S,14S,17S)-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] benzoate C25H30O3
(E)-3-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-4,5,6,7-tetrahydro-1-benzofuran-2-yl]prop-2-enoic acid C25H30O3