Gypsogenin–3–O–glucuronide

cas: 96553-02-5 — see every product listed under this CAS number, including other names

Gypsogenin–3–O–glucuronide (CAS 96553-02-5) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 1mg, 10mg, 20mg. Offered by: GLPBio.

brandGLPBio
catalog numberGC38792-5
cas96553-02-5
size5mg
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Available pack sizes

brand size price
GLPBio 5mg 1097.85 Pln
GLPBio 1mg 657.89 Pln
GLPBio 10mg 1579.94 Pln
GLPBio 20mg 2394.35 Pln

properties

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

(4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methoxycarbonyloxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid (CAS 96553-02-5) is a chemical compound with the molecular formula C37H56O10 and a molecular weight of 660.8 g/mol. IUPAC name: (4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methoxycarbonyloxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid. InChIKey: LHZZULHOQSQSJN-UPGAAKEKSA-N.

Identity
Molecular formulaC37H56O10
Molecular weight660.8 g/mol
IUPAC name(4aS,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-methoxycarbonyloxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChIKeyLHZZULHOQSQSJN-UPGAAKEKSA-N
SMILESC[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)OC)O)O)O

Computed by PubChem (NCBI)

Synonyms: gypsogenin-3-O-glucuronide, Methyl gypsogenin 3-O-beta-D-glucuronopyranoside, Methyl gypsogenin-3-O-glucuronide, orb1302327, orb3140653, Gypsogenin-3-O-(6-O-methyl-glucoside
Isomers (same molecular formula)
[(1R,1'R,3'R,4S,4'R,5R,5'R,6'R,10'S,12'S,13'S,16'R,18'S,21'R)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate C37H56O10
[(1R,1'R,3'R,4R,4'R,5R,5'R,6'R,10'S,12'S,13'S,16'R,18'S,21'R)-1,4',6',12',17',17'-hexamethyl-18'-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-3'-yl] acetate C37H56O10
2-[(1S,2R,3R,7R,9S,12R,14R,17R,18R,19R,21R,22S)-2-hydroxy-3,8,8,17,19-pentamethyl-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracos-4-en-22-yl]propan-2-yl acetate C37H56O10

Also listed as

Gypsogenin-3-O-glucuronide, >95% (HPLC) TRC CAS 96553-02-5
Methyl gypsogenin-3-O-glucuronide, 99% AmBeed CAS 96553-02-5
Gypsogenin-3-O-glucuronide/ 99.33% (existing batch purity) TargetMol CAS 96553-02-5
(4aS,6aS,6bR,9R,10R,12aR,14bR)-9-formyl-2,2,6a,6b,9,12a-hexamethyl-10-(((2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(methoxycarbonyl)tetrahydro-2H-pyran-2-yl) oxy) -1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-ectadecahydrobenzene-4a(2H)-carboxylic acid, 99.87% ,, 99.87% , Chemat CAS 96553-02-5
Methyl gypsogenin-3-O-glucuronide, 99.89% MedChemExpress CAS 96553-02-5