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trans-Itraconazole structure, CAS 252964-65-1

trans-Itraconazole

CAS Number252964-65-1

SynonymsExact Mass 704.23900; PSA 104.70000; LogP 5.70730; InChIKey VHVPQPYKVGDNFY-KKHGCVKGSA-N; trans-ItraconazoleBioassay; View more; Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress; Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School; Target: HCMV UL50; External Id: HMS1262; External Id: HMS1315; Name: MELAS cybrid survival enhancement under low glucose conditions; External Id: HMS1419; Name: Stabilization of p53 in human papillomavirus-positive cells; Target: Cellular tumor antigen p53; External Id: HMS1485; Total 4, Current Page 1 of 1; Synonyms

Molecular FormulaC35H38Cl2N8O4

Molecular Weight705.63300

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Cat. No.: 2A-4201606 Purity:
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Quality Control of [ 252964-65-1 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number252964-65-1
Catalog No.2A-4201606
Chinese Name反式伊曲康唑
SynonymsExact Mass 704.23900; PSA 104.70000; LogP 5.70730; InChIKey VHVPQPYKVGDNFY-KKHGCVKGSA-N; trans-ItraconazoleBioassay; View more; Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress; Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School; Target: HCMV UL50; External Id: HMS1262; External Id: HMS1315; Name: MELAS cybrid survival enhancement under low glucose conditions; External Id: HMS1419; Name: Stabilization of p53 in human papillomavirus-positive cells; Target: Cellular tumor antigen p53; External Id: HMS1485; Total 4, Current Page 1 of 1; Synonyms
Molecular FormulaC35H38Cl2N8O4
Molecular Weight705.63300
PubChem ID165241312
SMILESCCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O
InChIInChI=1S/C35H38Cl2N8O4/c1-3-25(2)45-34(46)44(24-40-45)29-7-5-27(6-8-29)41-14-16-42(17-15-41)28-9-11-30(12-10-28)47-19-31-20-48-35(49-31,21-43-23-38-22-39-43)32-13-4-26(36)18-33(32)37/h4-13,18,22-25,31H,3,14-17,19-21H2,1-2H3/t25?,31-,35+/m1/s1
InChI KeyVHVPQPYKVGDNFY-KKHGCVKGSA-N
Transport InfoProduct name: trans-itraconazole
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