(2R,4R,5S,16S)-15-[(2S,3S,4S,5R)-5-Ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one | CAS No. 110369-52-3

(2R,4R,5S,16S)-15-[(2S,3S,4S,5R)-5-Ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one

Basic Information

CAS Number

110369-52-3

Molecular Formula

C29H50O6

Molecular Weight

494.7 g/mol

AD

Basic Physical Properties

CCC(C(C)C)C(C(C(C)C1CCC2C1(CCC3C2COC(=O)C4C3(CC(C(C4)O)O)C)C)O)O

InChI

InChI=1S/C29H50O6/c1-7-17(15(2)3)26(33)25(32)16(4)19-8-9-20-18-14-35-27(34)22-12-23(30)24(31)13-29(22,6)21(18)10-11-28(19,20)5/h15-26,30-33H,7-14H2,1-6H3/t16-,17+,18?,19?,20?,21?,22?,23-,24+,25-,26-,28+,29+/m0/s1

InChIKey

HJIKODJJEORHMZ-MWVCNTFMSA-N

LogP

3.780100000000005

Topological Polar Surface Area

107.22000000000001 Ų

Hydrogen Bond Donor/Acceptor

4 / 6

Complexity

770

Synonyms & References

English

  • (2R,4R,5S,16S)-15-[(2S,3S,4S,5R)-5-Ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one
  • 110369-52-3
  • 22S,23S-Homobrassinolide
  • (5S,6R,7aR,9aS)-10-((2S,3S,4S,5R)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl)-5,6-dihydroxy-7a,9a-dimethyltetradecahydro-1H-benzo[e]indeno[4,5-c]oxepin-3(12bH)-one
  • 22(S),23(S)-Homobrassinolide
  • 22(S),23(S)-HOMOBRASSINOLIDE
  • 23(s)-homobrassinolide

MDL Number

MFCD00058438

FAQ

What regulatory guidelines apply to (2R,4R,5S,16S)-15-[(2S,3S,4S,5R)-5-Ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one (CAS: 110369-52-3)?

This compound falls under the scope of various regulatory guidelines. In the European Union, it would be subject to REACH regulations. In the USA, FDA and EPA guidelines will apply. For detailed information, consult specific regulatory documents or contact relevant authorities.

Are there alternatives to (2R,4R,5S,16S)-15-[(2S,3S,4S,5R)-5-Ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one in synthesis?

Synthesis alternatives can include using analogs such as similar tetracyclic structures, isomers, or alternative reagents like ethyl acetoacetate derivatives. These alternatives can offer similar functionalities with potentially different synthetic routes and reactivity profiles.

What is the market or research trend for (2R,4R,5S,16S)-15-[(2S,3S,4S,5R)-5-Ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one (CAS: 110369-52-3)?

Market trends for this compound are largely driven by pharmaceutical and academic research interests. Recent research has focused on its potential as a pharmaceutical intermediate or novel therapeutic agent. Price trends are influenced by supply and demand in the chemical industry.

How should waste containing (2R,4R,5S,16S)-15-[(2S,3S,4S,5R)-5-Ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one (CAS: 110369-52-3) be handled?

Waste containing this compound should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration or chemical neutralization methods may be required. Ensure compliance with local environmental regulations and safety guidelines during handling and disposal.

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