CAS 57817-89-7

Kaur-16-en-18-oic acid, 13-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-, β-D-glucopyranosyl ester, (4α)-

Description:

Kaur-16-en-18-oic acid, 13-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-, β-D-glucopyranosyl ester, with CAS number 57817-89-7, is a complex glycosylated compound derived from the kaurene family of terpenoids. This substance features a kaurene backbone, characterized by a fused cyclohexane and cyclopentane ring structure, which is typical of many plant-derived terpenes. The presence of multiple sugar moieties, specifically β-D-glucopyranosyl units, indicates its potential role in biological systems, possibly enhancing solubility and bioavailability. Such glycosylation can also influence the compound's pharmacological properties, including its interaction with biological receptors and enzymes. Kaur-16-en-18-oic acid derivatives are often studied for their potential therapeutic applications, including anti-inflammatory and anticancer activities. The specific stereochemistry, denoted by the (4α)- configuration, suggests a particular spatial arrangement of atoms that may affect the compound's reactivity and biological function. Overall, this compound exemplifies the intricate relationship between structure and function in natural products.

Formula:C₃₈H₆₀O₁₈

InChI:InChI=1S/C38H60O18/c1-16-11-37-9-5-20-35(2,7-4-8-36(20,3)34(50)55-32-29(49)26(46)23(43)18(13-40)52-32)21(37)6-10-38(16,15-37)56-33-30(27(47)24(44)19(14-41)53-33)54-31-28(48)25(45)22(42)17(12-39)51-31/h17-33,39-49H,1,4-15H2,2-3H3/t17-,18-,19-,20+,21+,22-,23-,24-,25+,26+,27+,28-,29-,30-,31+,32+,33+,35-,36-,37-,38+/m1/s1

InChI key:InChIKey=UEDUENGHJMELGK-HYDKPPNVSA-N

SMILES:C[C@]12[C@]3([C@]4(C[C@](O[C@H]5[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@@H](O)[C@H](O)[C@@H](CO)O5)(C(=C)C4)CC3)CC[C@@]1([C@@](C(O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)=O)(C)CCC2)[H])[H]

Synonyms:

(4α)-β-D-Glucopyranosyl-13-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]kaur-16-en-18-oat
(4α)-β-D-glucopyranosyl 13-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]kaur-16-en-18-oate
1,2-Stevioside
13-[(2-O-β-D-glucopiranosil-β-D-glucopiranosil)oxi]kaur-16-en-18-oato de (4α)-β-D-glucopiranosilo
13-[(2-O-β-D-glucopyrannosyl-β-D-glucopyrannosyl)oxy]kaur-16-ene-18-oate de (4α)-β-D-glucopyrannosyle
1H-2,10a-Ethanophenanthrene, kaur-16-en-18-oic acid deriv.
E 960
Kaur-16-en-18-oic acid, 13-[(2-O-β-<span class="text-smallcaps">D</smallcap>-glucopyranosyl-β-<smallcap>D</smallcap>-glucopyranosyl)oxy]-, β-<smallcap>D</span>-glucopyranosyl ester, (4α)-
Stevian 50
Stevioside
Steviosin
α-G Sweet PX
α-G-Sweet
1-O-[(5bêta,8alpha,9bêta,10alpha,13alpha)-13-{[2-O-(bêta-D-Glucopyranosyl)-bêta-D-glucopyranosyl]oxy}-18-oxokaur-16-én-18-yl]-bêta-D-glucopyranose
(1R,4S,5R,9S,10R,13S)-13-{[(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxyméthyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yl]oxy}tétrahydro-2H-pyran-2-yl]oxy}-5,9-diméthyl-14-méthylènetétracyclo[11.2.1.0~1,10~.0~4,9~]hexadécane-5-carboxylate de (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yle
1-O-[(5beta,8alpha,9beta,10alpha,13alpha)-13-{[2-O-(beta-D-Glucopyranosyl)-beta-D-glucopyranosyl]oxy}-18-oxokaur-16-en-18-yl]-beta-D-glucopyranose
Kaur-16-en-18-oic acid, 13-[(2-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-, β-D-glucopyranosyl ester, (4α)-
(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl (1R,4S,5R,9S,10R,13S)-13-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-5,9-dimethyl-14-methylenetetracyclo[11.2.1.0~1,10~.0~4,9~]hexadecane-5-carboxylate
Stevia Sugar
(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl-(1R,4S,5R,9S,10R,13S)-13-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-5,9-dimethyl-14-methylentetracyclo[11.2.1.0~1,10~.0~4,9~]hexadecan-5-carboxylat
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