17-(2,3-Dihydroxy-5-(2-methylprop-1-en-1-yl)tetrahydrofuran-3-yl)-3-((5-hydroxy-3-((3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-((3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,4,8,14-tetramethylhexadecahydro-10H-cyclopenta[a]phenanthrene-10-carbaldehyde, 99%

cas: 157752-01-7 — see every product listed under this CAS number, including other names

17-(2,3-Dihydroxy-5-(2-methylprop-1-en-1-yl)tetrahydrofuran-3-yl)-3-((5-hydroxy-3-((3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-((3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,4,8,14-tetramethylhexadecahydro-10H-cyclopenta[a]phenanthrene-10-carbaldehyde, 99% (CAS 157752-01-7) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 25mg. Offered by: Chemat.

• 2D
• 3D

17-[2,3-dihydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-3-[5-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,4,8,14-tetramethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde (CAS 157752-01-7) is a chemical compound with the molecular formula C46H74O17 and a molecular weight of 899.1 g/mol. IUPAC name: 17-[2,3-dihydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-3-[5-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,4,8,14-tetramethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde. InChIKey: JJURGRVZASRDDE-UHFFFAOYSA-N.

Identity

Molecular formula	C46H74O17
Molecular weight	899.1 g/mol
IUPAC name	17-[2,3-dihydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-3-[5-hydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,4,8,14-tetramethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
InChIKey	JJURGRVZASRDDE-UHFFFAOYSA-N
SMILES	CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C5CCC6C(CCC6(C5(CCC4C3(C)C)C)C)C7(CC(OC7O)C=C(C)C)O)C=O)O)OC8C(C(C(CO8)O)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Gypenoside A, Gypenoside A [M+H]+, orb1222640, orb1296046, orb3140132

Isomers (same molecular formula)

(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5S)-3-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,17R,20R)-16-hydroxy-2,6,6,10,16-pentamethyl-17-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C₄₆H₇₄O₁₇

(2S,3R,4S,5S,6R)-2-[(2S,3R,4S,5S)-3-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-5-hydroxy-2-[[(1S,2R,5R,7S,10R,11R,14R,15S,16S,18R,20S)-16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol C₄₆H₇₄O₁₇

2-[2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-1-[3,4-dihydroxy-5-[[16-hydroxy-2,6,6,10,16-pentamethyl-17-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxolan-2-yl]ethoxy]oxane-3,4,5-triol C₄₆H₇₄O₁₇