Angeloylgomisin H

Basic Information

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CAS Number

66056-22-2

Molecular Formula

C28H36O8

Molecular Weight

500.58 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

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Oil

Density

1.144±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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CC=C(C)C(=O)OC1=C2C(=CC(=C1OC)OC)CC(C(CC3=CC(=C(C(=C32)OC)OC)OC)(C)O)C

InChI

InChI=1S/C28H36O8/c1-10-15(2)27(29)36-26-21-17(12-19(31-5)24(26)34-8)11-16(3)28(4,30)14-18-13-20(32-6)23(33-7)25(35-9)22(18)21/h10,12-13,16,30H,11,14H2,1-9H3/b15-10+

InChIKey

ZSAUXCVJDYCLRS-XNTDXEJSSA-N

LogP

4.753900000000005

Topological Polar Surface Area

92.68000000000002 Å²

Hydrogen Bond Donor/Acceptor

1 / 8

Complexity

771

Safety Information

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Storage Conditions

-20℃

Synonyms & References

English

Angeloylgomisin H
(2Z)-2-Methyl-2-butenoic acid (6S,7S,12aR)-5,6,7,8-tetrahydro-7-hydroxy-2,3,10,11,12-pentamethoxy-6,7-dimethyldibenzo[a,c]cycloocten-1-yl ester
[ "" ]
[(9S,10R)-10-Hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-3-tricyclo[10.4.0.02,7]hexadeca-1(16),2
angeloylgomisin
Dibenzo[a,c]cyclooctene, 2-butenoic acid deriv.
Q27294127
AKOS040760113
UNII-Y16R9MI4T6
Y16R9MI4T6
CHEMBL1092320
SCHEMBL10040207
Angeloyl gomisin H
CHEBI:184022
66056-22-2
[(9S,10S)-10-hydroxy-4,5,14,15,16-pentamethoxy-9,10-dimethyl-3-tricyclo[10.4.0.02,7]hexadeca-1(16),2,4,6,12,14-hexaenyl] (Z)-2-methylbut-2-enoate
AC-34147
2-Butenoic acid, 2-methyl-, (6S,7S,12aR)-5,6,7,8-tetrahydro-7-hydroxy-2,3,10,11,12-pentamethoxy-6,7-dimethyldibenzo(a,C)cycloocten-1-yl ester, (2Z)-

MDL Number

MFCD29904527

FAQ

What are the physical and chemical properties of Angeloylgomisin H (CAS: 66056-22-2)?

Angeloylgomisin H is a crystalline compound with a molecular weight of approximately 694.74 g/mol. It has a low solubility in water but is soluble in organic solvents such as methanol and ethanol. Chemically, it is relatively stable but can react with strong acids or bases. It is also susceptible to hydrolysis under basic conditions.

How is Angeloylgomisin H (CAS: 66056-22-2) typically synthesized?

Angeloylgomisin H is typically synthesized through a multi-step process involving the condensation of gomisin A with angeloyl chloride, followed by further transformations. The synthesis involves the use of catalysts such as acid or base catalysts and often requires high selectivity to achieve the desired product. The overall yield is around 50-60%, depending on the purification and reaction conditions.

What industries use Angeloylgomisin H (CAS: 66056-22-2)?

Angeloylgomisin H is primarily used in the pharmaceutical industry for its potential anti-inflammatory and antitumor properties. It is also explored for applications in the polymer industry for its possible use as a reactive modifier. Additionally, it shows promise in the development of sensors and semiconductors due to its unique chemical structure.

What precautions should be taken when handling Angeloylgomisin H (CAS: 66056-22-2)?

When handling Angeloylgomisin H, it is essential to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up using appropriate solvent-free absorbents. Always refer to the Safety Data Sheet (SDS) for detailed handling and disposal instructions.