Ailanthone | CAS No. 981-15-7

Ailanthone

Basic Information

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CAS Number

981-15-7

Molecular Formula

C20H24O7

Molecular Weight

376.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

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

Basic Physical Properties

Physical State

Powder

Density

1.47

Solubility

N/A

SMILES

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CC1=CC(=O)C(C2(C1CC3C45C2C(C(C(=C)C4CC(=O)O3)O)(OC5)O)C)O

InChI

InChI=1S/C20H24O7/c1-8-4-12(21)16(24)18(3)10(8)5-13-19-7-26-20(25,17(18)19)15(23)9(2)11(19)6-14(22)27-13/h4,10-11,13,15-17,23-25H,2,5-7H2,1,3H3/t10-,11-,13+,15+,16+,17+,18+,19+,20+/m0/s1

InChIKey

WBBVXGHSWZIJST-LVDWTMBPSA-N

LogP

0.08629999999999999

Topological Polar Surface Area

113.29000000000002 Å²

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

817

Safety Information

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Storage Conditions

-20℃

Synonyms & References

English

Ailanthone
13,21-Didehydrochaparrinone
Picrasa-3,13(21)-diene-2,16-dione,11,20-epoxy-1,11,12-trihydroxy-, (1b,11b,12a)-
Δ13-Dehydrochaparrinone
(1β,11β,12α)-11,20-Epoxy-1,11,12-trihydroxypicrasa-3,13(21)-diene-2,16-dione
[ "" ]
(1S,4R,5S,17S)-4,5,17-Trihydroxy-14,18-dimethyl-6-methylidene-3,10-dioxapentacyclo[9.8.0.01,7.04,19.
NSC132792
4,5,17-Trihydroxy-14,18-dimethyl-6-methylidene-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-
13,21-Didehydrochaparrinone,?13-Dehydrochaparrinone
Picrasa-3,13(21)-dien-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-, (1.beta.,11.beta.,12.alpha.)
Q13923477
Ailanthone, >=98% (HPLC)
Picrasa-3,13(21)-diene-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-, (1-beta,11-beta,12-alpha)-
s6885
2H-1,11c-(Epoxymethano)phenanthro(10,1-bc)pyran-5,10(3H,6ah)-dione, 1,3a,4,7,7a,11,11a,11b-octahydro-8,11a-beta-dimethyl-3-methylene-1-alpha,2-beta,11-beta-trihydroxy-
Ailantone
C08747
MS-26104
Picrasa-3,13(21)-diene-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-, (1beta,11beta,12beta)-
Ailanthone (7CI)
DTXSID10913455
DA-60860
SCHEMBL10734384
CHEMBL161015
Picrasa-3,13(21)-diene-2,16-dione, 11,20-epoxy-1,11,12-trihydroxy-, (1beta,11beta,12alpha)-
NS00094262
Z3251707588
TIX
HY-N1943
(1R,2R,3aS,3a1S,6aR,7aS,11S,11aS,11bR)-1,2,11-Trihydroxy-8,11a-dimethyl-3-methylene-2,3,3a,4,7,7a,11,11a-octahydro-1H-1,3a1-(epoxymethano)dibenzo[de,g]chromene-5,10(6aH,11bH)-dione

MDL Number

MFCD01729487

FAQ

What is Ailanthone (CAS: 981-15-7)?

Ailanthone is a natural polyphenol compound found in the Ailanthus altissima tree. It has a chemical formula of C15H12O7 and is known for its antioxidant and antimicrobial properties.

What are the main uses of Ailanthone (CAS: 981-15-7)?

Ailanthone is primarily used in pharmaceuticals for its potential anti-inflammatory and antitumor properties. It is also studied in research for its antioxidant and antimicrobial effects, and can be found in some dietary supplements.

Is Ailanthone (CAS: 981-15-7) safe?

Ailanthone is generally considered safe for consumption and use, but as with any chemical, it should be handled with care. It is important to follow safety guidelines and avoid contact with skin and eyes. Toxicity data suggests that it is not highly toxic, but detailed safety studies are recommended for specific applications.

How should Ailanthone (CAS: 981-15-7) be stored?

Ailanthone should be stored in a cool, dry place away from direct sunlight. It is recommended to keep it in a tightly sealed container to maintain its stability. Avoid storing it in high humidity or high temperature environments to prevent degradation and loss of efficacy.