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Reference substances

Reference substances

IUPAC name:
(3R,5R)-tert-Butyl 7-[2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl]-3,5-dihydroxyheptanoate

Inventory

CAS number:
134395-00-9
Synonyms
Names:
ATH2
tert-Butyl (3R,5R)-3,5-dihydroxy-7-[2-(4-fluorophenyl)- 5-(1-methylethyl)l-3-phenyl-4-(phenylcarbamoyl)]-1H-pyrrol-1-yl]heptanoate
tert-butyl (3R,5R)-7-(2-(4-fluorophenyl)-5-isopropyl-3-phenyl-4-(phenylcarbamoyl)-1H-pyrrol-1-yl)-3,5-dihydroxyheptanoate

Molecular and structural information

Molecular formula:
C37H43FN2O5
Molecular weight:
614.76
SMILES notation:
O=C(OC(C)(C)C)C[C@H](O)C[C@H](O)CCN1C(C2=CC=C(F)C=C2)=C(C3=CC=CC=C3)C(C(NC4=CC=CC=C4)=O)=C1C(C)C
InChl:
InChI=1S/C37H43FN2O5/c1-24(2)34-33(36(44)39-28-14-10-7-11-15-28)32(25-12-8-6-9-13-25)35(26-16-18-27(38)19-17-26)40(34)21-20-29(41)22-30(42)23-31(43)45-37(3,4)5/h6-19,24,29-30,41-42H,20-23H2,1-5H3,(H,39,44)/t29-,30-/m1/s1
Structural formula:
Chemical structure

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