(1aR,5aR,5bS,7aS,8S,8aS,9aR,9bS,9cR,9dR)-5a,7a-Dimethyl-1,1a,5,5a,5b,6,7,7a,8a,9,9a,9b,9c,9d-tetradecahydro-3'H-spiro[cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthrene-8,2'-furan]-3,5'(4H,4'H) -dione

Basic Information

View in Editor

CAS Number

67392-87-4

Molecular Formula

C24H30O3

Molecular Weight

366.5 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

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Physical State

Powder

Melting Point

199.0 to 203.0 deg-C

Boiling Point

552.2 oC at 760 mmHg

Density

1.26

Flash Point

241.6 oC

Solubility

DMSO: ≥15

Refractive Index

1.61

Specific Rotation

-180 º (c=0.5, chloroform)

SMILES

View in Editor

CC12CCC(=O)C=C1C3CC3C4C2CCC5(C4C6CC6C57CCC(=O)O7)C

InChI

InChI=1S/C24H30O3/c1-22-6-3-12(25)9-17(22)13-10-14(13)20-16(22)4-7-23(2)21(20)15-11-18(15)24(23)8-5-19(26)27-24/h9,13-16,18,20-21H,3-8,10-11H2,1-2H3/t13-,14+,15-,16+,18+,20-,21+,22-,23+,24+/m1/s1

InChIKey

METQSPRSQINEEU-HXCATZOESA-N

LogP

4.305900000000004

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

828

Safety Information

View Safety Information

GHS Hazard Pictograms

H360

Hazard Statement

H360 May damage fertility or the unborn child
Reproductive toxicity

Synonyms & References

English

MFCD00867350
EN300-19767634
Drospirenone, United States Pharmacopeia (USP) Reference Standard
Tox21_112216
NSC 760103
DROSPIRENONE [VANDF]
(6R,7R,8R,9S,10R,13S,14S,15S,16S,17S)-1,3',4',6,6a,7,8,9,10,11,12,13,14,15,15a,16-Hexadecahydro-10,13-dimethylspiro-(17H-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthrene-17,2'(5'H)-furan)-3,5'(2H)-dione
BDBM150275
6beta,7beta,15beta,16beta-dimethylene-3-oxo-17alpha-pregn-4-ene-21,17 carbolactone
DTXSID7046465
3-oxo-6alpha,7alpha,15alpha,16alpha-tetrahydro-7'H,16'H-dicyclopropa[6,7;15,16]-17alpha-pregn-4-ene-21,17-carbolactone
ZK 30595
Drospirenone [USAN:USP:INN:BAN]
DROSPIRENONE [USAN]
SR-01000942231-1
6-beta,7-beta:15-beta,16-beta-Dimethylene-3-oxo-17-alpha-pregn-4-ene-21,17-carbolactone
DTXCID5026465
3-oxo-6alpha,7alpha,15alpha,16alpha-tetrahydro-7'H,16'H-dicyclopropa(6,7;15,16)-17alpha-pregn-4-ene-21,17-carbolactone
NS00002775
Drospirenone, European Pharmacopoeia (EP) Reference Standard
DROSPIRENONE COMPONENT OF NEXTSTELLIS
ANGELIQ COMPONENT DROSPIRENONE
METQSPRSQINEEU-HXCATZOESA-N
DROSPIRENONE [EP MONOGRAPH]
Drospirenone for peak identification
NCGC00164590-04
CS-1863
DROSPIRENONE COMPONENT OF YASMIN
SCHEMBL153316
DROSPIRENONE (EP MONOGRAPH)
Drospirenone for peak identification, European Pharmacopoeia (EP) Reference Standard

MDL Number

MFCD00867350

Customs Code

2937290090

FAQ

What is (1aR,5aR,5bS,7aS,8S,8aS,9aR,9bS,9cR,9dR)-5a,7a-Dimethyl-1,1a,5,5a,5b,6,7,7a,8a,9,9a,9b,9c,9d-tetradecahydro-3'H-spiro[cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthrene-8,2'-furan]-3,5'(4H,4'H)-dione (CAS: 67392-87-4)?

This compound is a complex polycyclic lactone with a molecular structure featuring multiple hydroxyl groups and a fused ring system. Its chemical formula is C23H36O5, and it is known for its high molecular complexity and potential biological activity. It belongs to a class of organic compounds often studied for their pharmacological properties and structural diversity.

What are the main uses of (1aR,5aR,5bS,7aS,8S,8aS,9aR,9bS,9cR,9dR)-5a,7a-Dimethyl-1,1a,5,5a,5b,6,7,7a,8a,9,9a,9b,9c,9d-tetradecahydro-3'H-spiro[cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthrene-8,2'-furan]-3,5'(4H,4'H)-dione (CAS: 67392-87-4)?

This compound is primarily used in pharmaceutical research as a potential lead molecule for drug development. Its unique structure makes it a candidate for studying various biological mechanisms, including anti-inflammatory and anti-cancer properties. It may also find applications in organic synthesis and chemical research due to its structural complexity and reactivity.

Is (1aR,5aR,5bS,7aS,8S,8aS,9aR,9bS,9cR,9dR)-5a,7a-Dimethyl-1,1a,5,5a,5b,6,7,7a,8a,9,9a,9b,9c,9d-tetradecahydro-3'H-spiro[cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthrene-8,2'-furan]-3,5'(4H,4'H)-dione (CAS: 67392-87-4) safe?

The safety of this compound depends on its specific application and exposure conditions. As a research compound, it is generally considered safe when handled according to standard laboratory protocols. However, it is important to use appropriate personal protective equipment (PPE) and follow safety guidelines to minimize any potential risks. Always consult safety data sheets (SDS) for detailed information.

How should (1aR,5aR,5bS,7aS,8S,8aS,9aR,9bS,9cR,9dR)-5a,7a-Dimethyl-1,1a,5,5a,5b,6,7,7a,8a,9,9a,9b,9c,9d-tetradecahydro-3'H-spiro[cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthrene-8,2'-furan]-3,5'(4H,4'H)-dione (CAS: 67392-87-4) be stored?

This compound should be stored in a cool, dry, and dark place, ideally at 2-8°C. It should be kept in a sealed container to prevent moisture and air exposure. Avoid exposure to direct light and ensure storage in a well-ventilated area. Proper labeling and storage conditions are essential to maintain its stability and integrity.