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(3S,5S)-Atorvastatin Calcium Salt, TRC

Artikelnummer. 30332612
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1 mg
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30332612 1 mg
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Artikelnummer. 30332612 Leverandør Toronto Research Chemicals Leverandørnr. TRCA7917551MG

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Tekniske data

Kemisk navn eller materiale ent-Atorvastatin Calcium Salt
CAS 1105067-88-6
Molekylær formel 2 C33 H34 F N2 O5 . Ca
Mængde 1 mg
Synonym 1H-Pyrrole-1-heptanoic acid, 2-(4-fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-, calcium salt (2:1), (βS,δS)-, ent-Atorvastatin calcium salt, (βS,δS)-2-(4-Fluorophenyl)-β,δ-dihydroxy-5-(1-methylethyl)-3-phenyl-4-[(phenylamino)carbonyl]-1H-pyrrole-1-heptanoic acid calcium salt (2:1), (3S,5S)-Atorvastatin calcium salt, Atorvastatin Related Compound E (USP)
InChI formel InChI=1S/2C33H35FN2O5.Ca/c2*1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);/q;;+2/p-2/t2*26-,27-;/m00./s1
SMIL [Ca+2].CC(C)c1c(C(=O)Nc2ccccc2)c(c3ccccc3)c(c4ccc(F)cc4)n1CC[C@H](O)C[C@H](O)CC(=O)[O-].CC(C)c5c(C(=O)Nc6ccccc6)c(c7ccccc7)c(c8ccc(F)cc8)n5CC[C@H](O)C[C@H](O)CC(=O)[O-]
IUPAC navn calcium;(3S,5S)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate
Molekylvægt (g/mol) 1155.34
Formel vægt 1154.4529
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