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Calcipotriol

Name: Calcipotriol
Brand: 2A Biotech
SKU: 2A-9009538

CAS Number112828-00-9

Synonyms(1S,3R,5Z,7E,14ξ,22E,24S)-26,27-Cyclo-9,10-secocholesta-5,7,10,22-tetraene-1,3,24-triol; CALCIPOTRIOL; 24-CYCLOPROPYL-(1ALPHA,3BETA,5Z,7E,22E,24S)-9,10-SECOCHOLA-5,7,10(19),22-TETRAENE-1,3,24-TRIOL; MFCD00866630

Molecular FormulaC27H40O3

Molecular Weight412.60 (anhydrous basis)

Purity≥98 (HPLC)%

Density1.1±0.1 g/cm3

Boiling Point582.0±50.0 °C at 760 mmHg

Appearancepowder

MSDSChinese English

Cat. No.: 2A-9009538 Purity: ≥98 (HPLC)%

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Quality Control of [ 112828-00-9 ] Purity: ≥98 (HPLC)% SDS Specification MoL

Chemical & Physical Properties
CAS Number	112828-00-9
Catalog No.	2A-9009538
Chinese Name	卡泊三醇
Synonyms	(1S,3R,5Z,7E,14ξ,22E,24S)-26,27-Cyclo-9,10-secocholesta-5,7,10,22-tetraene-1,3,24-triol; CALCIPOTRIOL; 24-CYCLOPROPYL-(1ALPHA,3BETA,5Z,7E,22E,24S)-9,10-SECOCHOLA-5,7,10(19),22-TETRAENE-1,3,24-TRIOL; MFCD00866630
Molecular Formula	C27H40O3
Molecular Weight	412.60 (anhydrous basis)
Purity	≥98 (HPLC)
Density	1.1±0.1 g/cm3
Boiling Point	582.0±50.0 °C at 760 mmHg
Appearance	powder
PubChem ID	329775060
MDL Number	MFCD10567086
SMILES	O.C[C@H](\C=C\[C@@H](O)C1CC1)C2CCC3\C(CCC[C@]23C)=C\C=C4\C[C@@H](O)C[C@H](O)C4=C
InChI	1S/C27H40O3.H2O/c1-17(6-13-25(29)20-8-9-20)23-11-12-24-19(5-4-14-27(23,24)3)7-10-21-15-22(28)16-26(30)18(21)2;/h6-7,10,13,17,20,22-26,28-30H,2,4-5,8-9,11-12,14-16H2,1,3H3;1H2/b13-6+,19-7+,21-10-;/t17-,22-,23-,24+,25-,26+,27-;/m1./s1
InChI Key	XBKHACNRWFKJNC-MANNPBRJSA-N
NACRES Code	NA.77
UNSPSC	12352200
MSDS	msds/9538_1_112828_00_9.pdf
Transport Info	Product Name: Calcipotriol Hydrate

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Calcipotriol

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