(1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol

Basic Information

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CAS Number

512-06-1

Molecular Formula

C27H42O3

Molecular Weight

414.63 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Polymers and Plastics Thermoplastics Polyolefins

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

527.1°C at 760 mmHg

Density

1.13

Flash Point

272.6°C

Solubility

N/A

Refractive Index

1.564

SMILES

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CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)OC1

InChI

InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17-,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1

InChIKey

WQLVFSAGQJTQCK-CAKNJAFZSA-N

LogP

5.713900000000006

Topological Polar Surface Area

38.69 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

746

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

CS-0018583
C08918
NS00093689
512-06-1
NSC-226132
(22R,25S)-(20.ALPHA.)-SPIROST-5-EN-3.BETA.-OL
Neodiosgenin
(1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol
AC-8895
25-epi-Diosgenin
SPIROST-5-EN-3-OL, (3.BETA.,25S)-
LMST01080045
US11660306, Example Yamogenin
s5675
(2'R,4S,5'S,6aR,6bS,8aS,8bR,9S,11aS,12aS,12bS)-5',6a,8a,9-tetramethyl-1,3,3',4,4',5,5',6,6a,6b,6',7,8,8a,8b,9,11a,12,12a,12b-icosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-4-ol
Q8048088
(20alpha,22r,25s)-Spirosta-5-ene-3beta-ol
WQLVFSAGQJTQCK-CAKNJAFZSA-N
NSC 226132
(22r,25s)-(20alpha)-spirost-5-en-3beta-ol
BDBM604165
AKOS025402417
Jamogenin
CHEBI:10086
Yamogenin - 70%
CHEMBL400807
DTXCID201331882
(25S)-spirost-5-en-3beta-ol
XY165194
(2R,5'S)-5'-tetramethylspiro[[?]-2,2'-tetrahydropyran]ol
HY-N2078

MDL Number

MFCD20377911

FAQ

What is (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol (CAS: 512-06-1)?

The compound (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol is a complex organic compound with a unique spiro structure. It is characterized by its specific stereochemistry and contains tetramethyl groups. This compound is primarily used in pharmaceuticals and research for its unique structural properties.

What are the main uses of (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol (CAS: 512-06-1)?

The main uses of (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol include pharmaceutical applications, especially in the development of novel drugs, and research for its unique structural properties.

Is (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol (CAS: 512-06-1) safe?

The compound (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol is generally safe when handled with appropriate safety precautions. However, it should be stored in a dry, cool, and well-ventilated area, away from strong oxidizers and heat sources. Always follow proper personal protective equipment guidelines when working with this compound.

How should (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol (CAS: 512-06-1) be stored?

The compound (1S,2S,4S,5'S,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-ol should be stored in a tightly sealed container, away from direct sunlight and heat. Maintain temperatures below 25°C and store in a dry, cool, and well-ventilated area. Avoid contact with water and strong oxidizers.