产品名称

英文名称：Doxercalciferol

同义词

Doxercalciferol、54573-75-0、Hectorol、1-Hydroxyergocalciferol、1alpha-Hydroxyergocalciferol、1alpha-hydroxyvitamin D2、TSA 840、1-alpha-Hydroxyvitamin D2、1-alpha-hydroxyergocalciferol、1-Hydroxyvitamin D2、Doxercalciferolum、UNII-3DIZ9LF5Y9、3DIZ9LF5Y9、1.alpha.-Hyd、(5Z,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraene-1α,3β-diol、1α-Hydroxyergocalciferol、1α-Hydroxyvitamin D2、1α-OHD2、1-α-Hydroxyvitamin D2、1-Hydroxyergocalciferol、TSA 840 1α-OHD2 1-α-Hydroxyvitamin D2 1-Hydroxyergocalciferol TSA 840

产品性质

CAS编号：54573-75-0

分子式：C28H44O2

分子量：412.65

MDL号：MFCD00871065

PubChem编号：5281107

别名：(5Z,7E,22E)-9,10-Secoergosta-5,7,10(19),22-tetraene-1α,3β-diol|1α-Hydroxyergocalciferol|1α-Hydroxyvitamin D2|1α-OHD2|1-α-Hydroxyvitamin D2|1-Hydroxyergocalciferol|TSA 840 1α-OHD2 1-α-Hydroxyvitamin D2 1-Hydroxyergocalciferol TSA 840

英文别名：Doxercalciferol|54573-75-0|Hectorol|1-Hydroxyergocalciferol|1alpha-Hydroxyergocalciferol|1alpha-hydroxyvitamin D2|TSA 840|1-alpha-Hydroxyvitamin D2|1-alpha-hydroxyergocalciferol|1-Hydroxyvitamin D2|Doxercalciferolum|UNII-3DIZ9LF5Y9|3DIZ9LF5Y9|1.alpha.-Hyd

规格或纯度：98%

英文名称：Doxercalciferol

生化机理：维生素D2类似物，充当维生素D受体激活剂（VDRA）。

储存温度：-20°C储存

运输条件：超低温冰袋运输

备注：卖完停产，不再备货

ALogP：6.3

IUPAC Name：(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

INCHI：InChI=1S/C28H44O2/c1-18(2)19(3)9-10-20(4)25-13-14-26-22(8-7-15-28(25,26)6)11-12-23-16-24(29)17-27(30)21(23)5/h9-12,18-20,24-27,29-30H,5,7-8,13-17H2,1-4,6H3/b10-9+,22-11+,23-12-/t19-,20+,24+,25+,26-,27-,28+/m0/s1

InChi Key：HKXBNHCUPKIYDM-CGMHZMFXSA-N

Canonical SMILES：CC(C)C(C)C=CC(C)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C

Isomeric SMILES：C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C

WGK Germany：3

PubChem CID：5281107

Wikipedia：Doxercalciferol

CAS Registry No.：54573-75-0

ChEMBL Ligand：CHEMBL1200810

ChEBI：CHEBI4712

RCSB PDB Ligand：V2H

DrugCentral Ligand：957

溶解性：溶于ethanol, 最高浓度 (mg/mL) 20.63, 最高浓度(mM) 50；溶于DMSO, 最高浓度 (mg/mL) 4.13, 最高浓度(mM) 10

敏感性：对热敏感

熔点：140 °C

象形图：

信号词：Danger

危险声明：H300 Fatal if swallowed

预防措施声明：P321,P405,P501,P264,P270,P330,P301+P316

Merck Index：3436

产品包装