Asperulosidic Acid Methyl Ester

Basic Information

View in Editor

CAS Number

14260-99-2

Molecular Formula

C19H26O12

Molecular Weight

446.41 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Oil

Solubility

Methanol; Water

SMILES

View in Editor

CC(=O)OCC1=CC(C2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O

InChI

InChI=1S/C19H26O12/c1-7(21)28-5-8-3-10(22)13-9(17(26)27-2)6-29-18(12(8)13)31-19-16(25)15(24)14(23)11(4-20)30-19/h3,6,10-16,18-20,22-25H,4-5H2,1-2H3/t10-,11+,12?,13?,14+,15-,16+,18-,19-/m0/s1

InChIKey

YSOBQIMODQOGKQ-CQTQKBAKSA-N

LogP

-2.687499999999997

Topological Polar Surface Area

181.44 Å²

Hydrogen Bond Donor/Acceptor

5 / 12

Complexity

748

Safety Information

View Safety Information

Storage Conditions

2-8℃

Synonyms & References

English

AKOS032962362
SCHEMBL9057631
NCGC00380265-01
CHEMBL3937733
HY-N6245
14260-99-2
(1S)-1alpha-(beta-D-Glucopyranosyloxy)-5beta-hydroxy-7-(acetoxymethyl)-1,4aalpha,5,7aalpha-tetrahydrocyclopenta[c]pyra
ASPERULOSIDICACIDMETHYLESTER
(1S)-1alpha-(beta-D-Glucopyranosyloxy)-5beta-hydroxy-7-(acetoxymethyl)-1,4aalpha,5,7aalpha-tetrahydrocyclopenta[c]pyran-4-carboxylic acid methyl ester
CS-0032780
FS-10348
(E)-3-(4-Methoxy-3-(propionyloxy)phenyl)-2-methylacrylic acid
ASPERULOSIDIC ACID METHYL ESTER
CHEBI:182720
Daphylloside
PD100185
NCGC00380265-01_C19H26O12_Cyclopenta[c]pyran-4-carboxylic acid, 7-[(acetyloxy)methyl]-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-, methyl ester, (1S,4aS,5S,7aS)-
methyl (1S,4aS,5S,7aS)-7-(acetyloxymethyl)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
Cyclopenta[c]pyran-4-carboxylicacid, 7-[(acetyloxy)methyl]-1-(b-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-, methyl ester,(1S,4aS,5S,7aS)-
Cyclopenta[c]pyran-4-carboxylicacid, 7-[(acetyloxy)methyl]-1-(b-D-glucopyranosyloxy)-1,4a,5,7a...
Cyclopenta[c]pyran-4-carboxylicacid, 7-[(acetyloxy)methyl]-1-(b-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-, methyl
Methyl (1S,4aS,5S,7aS)-7-(acetoxymethyl)-1-(β-D-glucopyranosyloxy )-5-hydroxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
Asperulosid
asperulosidic acid methyl ester
RUBICHLORIC ACID
[ "" ]
Methyl asperulosidic acid
(1S)-7-(Acetoxymethyl)-1α-(β-D-glucopyranosyloxy)-1,4aα,5,7aα-tetrahydro-5β-hydroxycyclopenta[c]pyran-4-carboxylic acid methyl ester
(1S)-1α-(β-D-Glucopyranosyloxy)-5β-hydroxy-7-(acetoxymethyl)-1,4aα,5,7aα-tetrahydrocyclopenta[c]pyran-4-carboxylic acid methyl ester
(1S,4aα,7aα)-7-[(Acetyloxy)methyl]-1α-(β-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5β-hydroxycyclopenta[c]pyran-4-carboxylic acid methyl ester
Methyl (4aR,7aR)-7-(acetyloxymethyl)-5-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,

MDL Number

MFCD20260943

FAQ

What is Asperulosidic Acid Methyl Ester (CAS: 14260-99-2)?

Asperulosidic Acid Methyl Ester (CAS: 14260-99-2) is a chemical compound derived from asarone, a sesquiterpene. It has a molecular formula of C15H22O4 and is used in various applications due to its unique properties.

What are the main uses of Asperulosidic Acid Methyl Ester (CAS: 14260-99-2)?

Asperulosidic Acid Methyl Ester (CAS: 14260-99-2) is primarily used in the pharmaceutical industry as an intermediate for the synthesis of other compounds. It is also utilized in aroma compounds and for research purposes.

Is Asperulosidic Acid Methyl Ester (CAS: 14260-99-2) safe?

Asperulosidic Acid Methyl Ester (CAS: 14260-99-2) is generally considered safe when handled with appropriate precautions. It is important to follow safety guidelines, such as wearing protective gloves and goggles, and storing it in a cool, dry place away from direct sunlight.

How should Asperulosidic Acid Methyl Ester (CAS: 14260-99-2) be stored?

Asperulosidic Acid Methyl Ester (CAS: 14260-99-2) should be stored in tightly sealed containers in a cool, dry place away from direct sunlight. It should be kept at a temperature not exceeding 25°C and should be protected from moisture and light exposure to maintain its stability and purity.