Tacalcitol Hydrate

Basic Information

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CAS Number

93129-94-3

Molecular Formula

C27H46O4

Molecular Weight

434.66 g/mol

Chemical Classification

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Boiling Point

565°Cat760mmHg

Density

1.06

Flash Point

238.4°C

SMILES

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CC(C)C(CCC(C)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C)O.O

InChI

InChI=1S/C27H44O3.H2O/c1-17(2)25(29)13-8-18(3)23-11-12-24-20(7-6-14-27(23,24)5)9-10-21-15-22(28)16-26(30)19(21)4;/h9-10,17-18,22-26,28-30H,4,6-8,11-16H2,1-3,5H3;1H2/b20-9+,21-10-;/t18-,22-,23-,24+,25-,26+,27-;/m1./s1

InChIKey

UCLYOJXQGOXQKJ-XXBHHXRKSA-N

LogP

4.735900000000006

Topological Polar Surface Area

92.19 Å²

Hydrogen Bond Donor/Acceptor

5 / 4

Complexity

676

Synonyms & References

English

Tacalcitol monohydrate
1-alpha,24(R)-Dihydroxyvitamin D3 monohydrate
1,24(R)-Dihydroxyvitamin D3 monohydrate
Tacalcitol Monohydra
9,10-Secocholesta-5,7,10(19)-triene-1,3,24-triol, monohydrate, (1α,3β,5Z,7E,24R)- (9CI)
1α,24(R)-Dihydroxy-vitamin D3 monohydrate
1α,24(R)-Dihydroxycholecalciferol monohydrate
UNII-B3Q63NVN9R
Tacalcitol hydrate
(+)-(5Z,7E,24R)-9,10-SECOCHOLESTA-5,7,10(19)-TRIENE-1.ALPHA.,3.BETA.,24-TRIOL MONOHYDRATE
TACALCITOL HYDRATE [JAN]
PD143597
Bonalfa high
(1R,3S)-5-[2-[(1R,3aR,7aS)-1-[(2R,5S)-5-hydroxy-6-Methyl-heptan-2-yl]-7a-Methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-Methylidene-cyclohexane-1,3-diol
TACALCITOL MONOHYDRATE (EP MONOGRAPH)
TACALCITOL MONOHYDRATE [WHO-DD]
Q27274319
TACALCITOL MONOHYDRATE
Tacalcitol hydrate (JP17)
TACALCITOL MONOHYDRATE [EP MONOGRAPH]
(1S,3R,5Z,7E,24R)-9,10-Secocholesta-5,7,10(19)-triene-1,3,24-triol monohydrate
Tacalcitol for system suitability
AKOS030527012
DA-58235
SCHEMBL1376069
Curatoderm (TN)
B3Q63NVN9R
(+)-(5Z,7E,24R)-9,10-Secocholesta-5,7,10(19)-triene-1alpha,3beta,24-triol monohydrate
93129-94-3
1,24(R)-Dihydroxyvitamin D3, monohydrate
D01472

MDL Number

MFCD13184757

FAQ

What is Tacalcitol Hydrate (CAS: 93129-94-3)?

Tacalcitol Hydrate is a vitamin D analog used in the treatment of chronic skin diseases such as psoriasis. It is a water-soluble form of tacalcitol, which is a derivative of vitamin D3. The chemical formula is C27H44O4·2H2O.

What are the main uses of Tacalcitol Hydrate (CAS: 93129-94-3)?

Tacalcitol Hydrate is primarily used in the treatment of chronic skin conditions, including psoriasis, and is effective in reducing the symptoms and signs of these conditions. It is also used in dermatological research for studying the effects of vitamin D analogs on skin health.

Is Tacalcitol Hydrate (CAS: 93129-94-3) safe?

Tacalcitol Hydrate is generally considered safe when used as directed. However, it should be used under medical supervision due to potential side effects such as skin irritation and hypercalcemia. Users should follow all safety precautions and consult a healthcare provider for any concerns.

How should Tacalcitol Hydrate (CAS: 93129-94-3) be stored?

Tacalcitol Hydrate should be stored in a tightly sealed container at room temperature, protected from moisture and light. It should be kept away from children and pets to prevent accidental ingestion. Avoid exposure to extreme temperatures and humidity to maintain its efficacy and stability.