(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-6-(3-Furyl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0~1,14~.0~2,11~.0~5,10~.0~8,10~]henicosane-4,21-diyl diacetate

Basic Information

View in Editor

CAS Number

58812-37-6

Molecular Formula

C30H38O11

Molecular Weight

574.62 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 Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Melting Point

244-245°C

Boiling Point

714℃ at 760 mmHg

Density

1.2084 (rough estimate)

Solubility

Methanol,Ethyl Acetate,DMSO,Acetontrile

Refractive Index

1.5970 (estimate)

SMILES

View in Editor

CC(=O)OC1CC(C23COC(C1(C2CC(C4(C3C(=O)C(C5(C46C(O6)CC5C7=COC=C7)C)OC(=O)C)C)O)C)O)O

InChI

InChI=1S/C30H38O11/c1-13(31)39-20-10-19(34)29-12-38-25(36)26(20,3)17(29)9-18(33)28(5)23(29)22(35)24(40-14(2)32)27(4)16(15-6-7-37-11-15)8-21-30(27,28)41-21/h6-7,11,16-21,23-25,33-34,36H,8-10,12H2,1-5H3/t16-,17-,18+,19-,20+,21+,23-,24-,25+,26+,27+,28+,29+,30+/m0/s1

InChIKey

NAHTXVIXCMUDLF-RFNFAWMESA-N

LogP

1.4661

Topological Polar Surface Area

165.26 Å²

Hydrogen Bond Donor/Acceptor

3 / 11

Complexity

1190

Safety Information

View Safety Information

Storage Conditions

2-8℃

Synonyms & References

English

Chuanliansu
MFCD00210564
AS-56295
AKOS025311566
Toosendanin
[(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-Acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate
HY-N0263
12-Acetoxyamoorastatin
CHEMBL503044
CS-0008285
[(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-4-acetyloxy-6-(uran-3-yl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-21-yl] acetate
CHEBI:192461
58812-37-6
Q-100679
24-Norchola-20,22-diene-4-carboxaldehyde,3,12-bis(acetyloxy)-14,15:21,23-diepoxy-1,7,19-trihydroxy-4,8-dimethyl-11-oxo-,cyclic4,19-hemiacetal, [C(R),1α,3α,4β, 5α,7α,12α,13α,14β,15β,17α]-
28-Deacetylsendanin
12-AcetoxyaMoorastatin
Trichilinin
N1864
[(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16S,19R,21S)-4-Acetyloxy-6-(furan-3-yl)-12,16,19-trihydroxy-
28-Deacetylsendanin,Chuanliansu,29-Deacetylsendanin

MDL Number

MFCD00210564

Customs Code

29389090

FAQ

What is (1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-6-(3-Furyl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0~1,14~.0~2,11~.0~5,10~.0~8,10~]henicosane-4,21-diyl diacetate (CAS: 58812-37-6)?

This is a complex organic compound with the CAS number 58812-37-6. It contains multiple hydroxyl, methyl, and acetyl groups along with a furan ring. The compound is known for its structural complexity and is often used in specialized chemical research due to its unique functional groups and stereochemistry.

What are the main uses of (1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-6-(3-Furyl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0~1,14~.0~2,11~.0~5,10~.0~8,10~]henicosane-4,21-diyl diacetate (CAS: 58812-37-6)?

The compound is primarily used in pharmaceutical research for its potential biological activity. It may also find applications in the development of new drugs and as a structural analog in chemical synthesis. Its complex structure makes it valuable for studying molecular interactions and stereochemical effects.

Is (1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-6-(3-Furyl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0~1,14~.0~2,11~.0~5,10~.0~8,10~]henicosane-4,21-diyl diacetate (CAS: 58812-37-6) safe?

The safety of this compound depends on its specific application and exposure conditions. As with many complex organic molecules, it should be handled with care, using appropriate personal protective equipment. Safety data is limited, so following standard laboratory safety protocols is recommended for its use and storage.

How should (1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,16R,19S,21R)-6-(3-Furyl)-12,16,19-trihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.0~1,14~.0~2,11~.0~5,10~.0~8,10~]henicosane-4,21-diyl diacetate (CAS: 58812-37-6) be stored?

This compound should be stored in a cool, dry, and dark place to maintain its stability. It is best kept in a sealed container at a temperature below 25°C and away from moisture and direct light. Proper storage is essential to prevent degradation and ensure long-term usability.