Ingenol Mebutate

Basic Information

View in Editor

CAS Number

75567-37-2

Molecular Formula

C25H34O6

Molecular Weight

430.53 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

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Physical State

Powder

Melting Point

No data available

Boiling Point

576.9±50.0 °C at 760 mmHg

Water Solubility

Soluble in 100% ethanol, DMSO, dichloromethane, and methanol. Insoluble in water.

Flash Point

191.4±23.6 °C

Solubility

DMSO: soluble15mg/mL, clear

Vapor Pressure

3.17X10-15 mm Hg at 25 °C (est)

SMILES

View in Editor

CC=C(C)C(=O)OC1C(=CC23C1(C(C(=CC(C2=O)C4C(C4(C)C)CC3C)CO)O)O)C

InChI

InChI=1S/C25H34O6/c1-7-12(2)22(29)31-21-13(3)10-24-14(4)8-17-18(23(17,5)6)16(20(24)28)9-15(11-26)19(27)25(21,24)30/h7,9-10,14,16-19,21,26-27,30H,8,11H2,1-6H3/b12-7-/t14-,16+,17-,18+,19-,21+,24+,25+/m1/s1

InChIKey

VDJHFHXMUKFKET-WDUFCVPESA-N

LogP

2.3323

Topological Polar Surface Area

104.06000000000002 Å²

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

926

Safety Information

View Safety Information

Storage Conditions

2-8℃

Synonyms & References

English

Ingenol mebutate [USAN]
Picato
AGN 204332
D06BX02
(1aR,2S,5R,5aS,6S,8aS,9R,10aR)-5,5a-dihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-11-oxo-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta(a)cyclopropa(E)(10)annulen-6-yl (2Z)-2-methylbut-2-enoate
D09393
mebutate d'ingenol
CHEBI:66913
HSDB 8308
Euphorbia factor An1
DTXSID301025610
AKOS024457952
Ingenol 3-angelate
Euphorbia factor H1
[dihydroxy-(hydroxymethyl)-tetramethyl-oxo-[?]yl] (Z)-2-methylbut-2-enoate
3-Angeloylingenol
3-Ingenyl angelate
HB0482
UNII-7686S50JAH
PEP005
(2Z)-2-Methyl-2-butenoic acid (1aR,2S,5R,5aS,6S,8aS,9R,10aR)-1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-6-yl ester
INGENOL MEBUTATE [MI]
PEP 005
INGENOL MEBUTATE [ORANGE BOOK]
2-Butenoic acid, 2-methyl-, (1aR,2S,5R,5aS,6S,8aS,9R,10aR)-1a,2,5,5a,6,9,10,10a-octahydro-5,5a-dihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-11-oxo-1H-2,8a-methanocyclopenta(a)cyclopropa(e)cyclodecen-6-yl ester, (2Z)-
[(1S,4S,5S,6R,9S,10R,12R,14R)-5,6-dihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxo-4-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] (Z)-2-methylbut-2-enoate
Picato (TN)
INGENOL MEBUTATE [INN]
CHEBI:228675
AGN204332
ingenoli mebutas

MDL Number

MFCD07784504

FAQ

What is Ingenol Mebutate (CAS: 75567-37-2)?

Ingenol Mebutate (CAS: 75567-37-2) is a plant-derived sesquiterpene lactone used in dermatological applications. It has a chemical formula of C20H28O4 and is known for its anti-inflammatory and antiproliferative properties.

What are the main uses of Ingenol Mebutate (CAS: 75567-37-2)?

Ingenol Mebutate (CAS: 75567-37-2) is primarily used in the treatment of actinic keratosis and other dermatological conditions. It is available as a topical formulation and is effective in promoting the removal of precancerous skin lesions.

Is Ingenol Mebutate (CAS: 75567-37-2) safe?

Ingenol Mebutate (CAS: 75567-37-2) is generally considered safe when used as directed. However, it can cause skin irritation and photosensitivity, so appropriate protective measures, such as wearing sunscreen and protective clothing, are recommended.

How should Ingenol Mebutate (CAS: 75567-37-2) be stored?

Ingenol Mebutate (CAS: 75567-37-2) should be stored in a cool, dry place away from direct sunlight. It should be kept in a tightly closed container to protect it from moisture and air exposure. Avoid storing it in high temperatures or humid environments to maintain its stability and efficacy.