(3S,5Z,7E)-(26,26,26,27,27,27-~2~H_6_)-9,10-Secocholesta-5,7,10-triene-3,25-diol | CAS No. 78782-98-6

(3S,5Z,7E)-(26,26,26,27,27,27-~2~H_6_)-9,10-Secocholesta-5,7,10-triene-3,25-diol

Basic Information

CAS Number

78782-98-6

Molecular Formula

C27H38D6O2

Molecular Weight

406.68 g/mol

AD

Basic Physical Properties

Melting Point

64-69°C

CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C

InChI

InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1/i3D3,4D3

InChIKey

JWUBBDSIWDLEOM-QFVHMXLQSA-N

LogP

6.733900000000008

Topological Polar Surface Area

40.46 Ų

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

655

Safety Information

View Safety Information

Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids
H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

  • Calcifediol-d6 (>90%)
  • AS-79833
  • Calcifediol-D6
  • D6-25-hydroxyvitamin D3
  • CHEMBL4594399
  • 78782-98-6
  • D6-25-hydroxyvitamin D3 (26,26,26,27,27,27-d6)
  • DTXSID20735347
  • 25-Hydroxy Vitamin D3 (26,26,26,27,27,27-d6)
  • (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-7,7,7-trideuterio-6-hydroxy-6-(trideuteriomethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol
  • 378HY809HV
  • AKOS040732700
  • CS-0819
  • HY-13332
  • UNII-378HY809HV
  • MFCD15071183
  • 1H-INDENE-1-PENTANOL, 4-((2Z)-2-((5S)-5-HYDROXY-2-METHYLENECYCLOHEXYLIDENE)ETHYLIDENE)OCTAHYDRO-.EPSILON.,7A-DIMETHYL-.ALPHA.,.ALPHA.-BIS(METHYL-D3)-, (.EPSILON.R,1R,3AS,4E,7AR)-
  • 1H-Indene-1-pentanol, 4-((2Z)-2-((5S)-5-hydroxy-2-methylenecyclohexylidene)ethylidene)octahydro-epsilon,7a-dimethyl-alpha,alpha-bis(methyl-d3)-, (epsilonR,1R,3aS,4E,7aR)-
  • (3S,5Z,7E)-(26,26,26,27,27,27-~2~H_6_)-9,10-Secocholesta-5,7,10-triene-3,25-diol
  • 9,10-Secocholesta-5,7,10(19)-triene-26,26,26,27,27,27-d6-3,25-diol, (3b,5Z,7E)-
  • 25HydroxyvitaminD3-D6(Dimethyl26,27-D6)
  • 9,10-Secocholesta-5,7,10(19)-triene-26,26,26,27,27,27-d6-3,25-diol,(3b,5Z,7E)-
  • D6-25-Hydroxyvitamin D3 (26,26,26,27,27,27-D6) solution
  • <26,27-2H6>-25-hydroxyvitamin D3
  • 25-Hydroxycholecalciferol-d6
  • 25-Hydroxyvitamin D3-d6
  • 25-Hydroxyvitamin D-d6
  • Calcidiol-d6
  • Didrogyl-d6
  • Hidroferol-d6
  • Ro 8-8892-d6

MDL Number

MFCD15071183

FAQ

What is (3S,5Z,7E)-(26,26,26,27,27,27-~2~H_6_)-9,10-Secocholesta-5,7,10-triene-3,25-diol (CAS: 78782-98-6)?

This compound is a complex steroid derivative with a unique molecular structure. It contains six hydroxyl groups and specific double bonds in its structure. It is commonly used in research and pharmaceuticals for its unique properties.

What are the main uses of (3S,5Z,7E)-(26,26,26,27,27,27-~2~H_6_)-9,10-Secocholesta-5,7,10-triene-3,25-diol (CAS: 78782-98-6)?

This compound is primarily used in research and pharmaceutical applications, aiding in the development of new drugs and as intermediates in the synthesis of other compounds. It is also utilized in some specialized industrial processes.

Is (3S,5Z,7E)-(26,26,26,27,27,27-~2~H_6_)-9,10-Secocholesta-5,7,10-triene-3,25-diol (CAS: 78782-98-6) safe?

This compound is generally considered safe for use in research and pharmaceutical applications when handled with appropriate safety measures. However, it should be stored away from heat and direct sunlight to minimize the risk of degradation. Proper protective equipment, such as gloves and goggles, should be worn during handling.

How should (3S,5Z,7E)-(26,26,26,27,27,27-~2~H_6_)-9,10-Secocholesta-5,7,10-triene-3,25-diol (CAS: 78782-98-6) be stored?

This compound should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to use airtight containers made of glass or suitable plastic to prevent degradation. The storage area should be well-ventilated to ensure good air circulation and reduce the risk of fire or explosion. Handle with care to avoid spills or damage to the container.

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