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1α,25-Dihydroxyvitamin D2

1α,25-Dihydroxyvitamin D2 structure

CAS No:
60133-18-8
Formula:
C28H44O3
Chemical Name:
1α,25-Dihydroxyvitamin D2
Synonyms:
1,3-Cyclohexanediol,4-methylene-5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R,2E)-5-hydroxy-1,4,5-trimethyl-2-hexen-1-yl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3S,5Z)-;9,10-Secoergosta-5,7,10(19),22-tetraene-1,3,25-triol,(1α,3β,5Z,7E,22E)-;(1R,3S,5Z)-4-Methylene-5-[(2E)-2-[(1R,3aS,7aR)-octahydro-1-[(1R,2E)-5-hydroxy-1,4,5-trimethyl-2-hexen-1-yl]-7a-methyl-4H-inden-4-ylidene]ethylidene]-1,3-cyclohexanediol;1α,25-Dihydroxyvitamin D2;1α,25-Dihydroxycalciferol;1α,25-Dihydroxyergocalciferol;Ercalcitriol;Ro 17-6218;1,25-Dihydroxyergocalciferol;1,25-Dihydroxyvitamin D2;1,25-Dihydroxycalciferol
Categories:
Analytical Chemistry > Standard

Description

Ercalcitriol (1α,25-Dihydroxy Vitamin D2) is a active metabolite of vitamin D2. IC50 value: Target: Ercalcitriol (1α,25-Dihydroxy Vitamin D2) exhibits equipotent antirachitic activity in rats as calcitriol. Ercalcitriol(1α,25-Dihydroxy Vitamin D2) is a VDR-like Receptors

Solid

1alpha,25-dihydroxyvitamin D2 is a hydroxycalciol that is vitamin D2 bearing additional hydroxy substituents at positions 1alpha and 25. It has a role as a bone density conservation agent, a human xenobiotic metabolite and a nutraceutical. It is a hydroxycalciol, a seco-ergostane and a vitamin D. It derives from a vitamin D2.

1α,25-Dihydroxyvitamin D2 Basic Attributes

Molecular Weight：

428.653

Exact Mass：

428.65

EC Number：

200-578-6

UNII：

5RWP08OQ36

DSSTox ID：

DTXSID90429509

Characteristics

PSA：

60.69000

XLogP3：

6.15

Density：

1.1±0.1 g/cm3

Boiling Point：

577.7±50.0 °C at 760 mmHg

Flash Point：

14℃

Refractive Index：

1.554

Storage Conditions：

−20°C

Safety Information

Transport codes：

UN 2811 6.1/PG 2

wgk germany：

hazard class code：

23/24/25-63-48/25-26-24/25-11

safety instructions：

36/37-45-28-16-7

Marks：

T,T+,F

Precautionary statement(s)：

P210-P280-P305 + P351 + P338-P337 + P313-P403 + P235

Hazard Statements：

H225-H319

GHS Classification：

|Danger|H301+H311 (97.44%): Toxic if swallowed or in contact with skin [Danger Acute toxicity, oral; acute toxicity, dermal]|P260, P264, P270, P271, P280, P284, P301+P310, P302+P352, P304+P340, P310, P312, P314, P320, P321, P322, P330, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1 alpha,25-dihydroxyvitamin D2

1α,25-Dihydroxyvitamin D2 Use and Manufacturing

Uses

The active metabolite of Vitamin D2 (V676040).

Use Classification：

Lipids -> Sterol Lipids [ST] -> Secosteroids [ST03] -> Vitamin D2 and derivatives [ST0301]

Computed Properties

Molecular Weight:428.6
XLogP3:4.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:428.32904526
Monoisotopic Mass:428.32904526
Topological Polar Surface Area:60.7
Heavy Atom Count:31
Complexity:758
Defined Atom Stereocenter Count:7
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1α,25-Dihydroxy vitamin D2 60133-18-8

CAS No.: 60133-18-8

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CAS No.: 60133-18-8

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Guide of 1α,25-Dihydroxyvitamin D2

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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