Quillaic acid, 99.30%

cas: 631-01-6 — see every product listed under this CAS number, including other names

Quillaic acid, 99.30% (CAS 631-01-6) is a chemical reagent available from Chemat. Available pack sizes: 50 mg, 25 mg, 5 mg, 10mM/1mL, 100 mg, 10 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-N0839-50 mg
cas631-01-6
size50 mg
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Available pack sizes

brand size price
MedChemExpress 50 mg 1945.09 Pln
MedChemExpress 25 mg 1271.71 Pln
MedChemExpress 5 mg 505.45 Pln
MedChemExpress 10mM/1mL 533.32 Pln
MedChemExpress 100 mg 3022.50 Pln
MedChemExpress 10 mg 695.86 Pln

properties

delivery time over 3 weeks
purity99.30%
Structural formula: {0} (CAS {1})

Quillaic acid is a pentacyclic triterpenoid that is olean-12-ene substituted by hydroxy groups at positions 3 and 16, an oxo group at position 23 and a carboxy group at position 28 (the 3beta,16alpha stereoisomer). It has a role as a metabolite and an anti-inflammatory agent. It is an aldehyde, a pentacyclic triterpenoid and a hydroxy monocarboxylic acid. It is a conjugate acid of a quillate. It derives from a hydride of an oleanane.

Source: ChEBI

Identity
Molecular formulaC30H46O5
Molecular weight486.7 g/mol
IUPAC name(4aR,5R,6aR,6aS,6bR,8aR,9S,10S,12aR,14bS)-9-formyl-5,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
InChIKeyMQUFAARYGOUYEV-UAWZMHPWSA-N
SMILESC[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)O)C)C)(C)C=O)O

Computed by PubChem (NCBI)

Synonyms: Quillaic acid, quillaja sapogenin, (3beta,4alpha,16alpha)-3,16-Dihydroxy-23-oxoolean-12-en-28-oic acid, (+)-QUILLAIC ACID, 3beta,16alpha-dihydroxy-23-oxoolean-12-en-28-oic acid, 3 beta,16 alpha-dihydroxy-23-oxoolean-12-en-28-oic acid, Saponin bark extract, Soapbark(saponaria)extract, QUILLAIC ACID [MI], orb1221934
Isomers (same molecular formula)
bis(3,5-ditert-butyl-4-hydroxybenzaldehyde);hydrate C30H46O5
(3S,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-3-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid C30H46O5
(1R,2R,4aS,6aR,6aS,6bR,8aR,9R,12aR,14bS)-1-hydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-2H-picene-4a-carboxylic acid C30H46O5
(1S,2R,3S,4R,7R,12R,14S,17R,18R,19R,21R,22S)-2-hydroxy-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosan-9-one C30H46O5
(5R,8S,9S,10S,11S,14R)-17-[(2R,4S)-4-[(2R)-3,3-dimethyloxiran-2-yl]-4-hydroxybutan-2-yl]-11-hydroxy-4,4,8,10,14-pentamethyl-2,5,6,7,9,11,12,15-octahydro-1H-cyclopenta[a]phenanthrene-3,16-dione C30H46O5
(1R,4aS,6aR,6aS,6bR,8aR,9S,10S,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-1,6a,6b,9,12a-pentamethyl-2-methylidene-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid C30H46O5
(1R,2R,4aS,6aR,6aS,6bR,8aR,11R,12aR,14bS)-1,11-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-2H-picene-4a-carboxylic acid C30H46O5
(5R,8S,9S,10S,14R)-4,4,8,10,14-pentamethyl-17-[(2R,4S,5R)-4,5,6-trihydroxy-6-methylheptan-2-yl]-2,5,6,7,9,15-hexahydro-1H-cyclopenta[a]phenanthrene-3,16-dione C30H46O5
(4aS,6aS,6aS,6bR,8aS,9R,10S,12aR,14bS)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-12-oxo-3,4,5,6,6a,7,8,8a,10,11,13,14b-dodecahydro-1H-picene-4a-carboxylic acid C30H46O5
(1R,2R,5S,8R,9R,10R,13R,14R,15R,16S,18R)-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5,15-dicarboxylic acid C30H46O5
(1R,2R,4aS,6aR,6aS,6bR,8R,8aR,12aR,14bS)-1,8-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-2H-picene-4a-carboxylic acid C30H46O5
(6aR,6bS,8aS,12aR,14aR,14bR)-3-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid C30H46O5

Also listed as

Quillaic Acid, >95% (HPLC) TRC CAS 631-01-6
Quillaic Acid/ 99.85% (existing batch purity) TargetMol CAS 631-01-6
Quillaic acid (Standard) MedChemExpress CAS 631-01-6
Quillaic acid, min. 95 %, 25 mg Roth CAS 631-01-6
Quillaic acid, min. 95 %, 50 mg Roth CAS 631-01-6
Quillaic acid, min. 95 %, 100 mg Roth CAS 631-01-6
Quillaic acid, 95% Chemat CAS 631-01-6

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