Substance Name: Anhydro simvastatin
RN: 210980-68-0
InChIKey: BIYWBTKPNWCYHM-RLSQPJRHSA-N

Molecular Formula

  • C25-H36-O4

Molecular Weight

  • 400.5554
2D chemical structure of 210980-68-0
 

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Names and Synonyms

Name of Substance

  • Anhydro simvastatin

Synonyms

  • (1S,3R,7S,8S,8aR)-3,7-Dimethyl-8-(2-((2R)-6-oxo-3,6-dihydro-2H-pyran-2-yl)ethyl)-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate
  • Anhydro simvastatin
  • Anhydro-simvastatin
  • Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-8-(2-((2R)-3,6-dihydro-6-oxo-2H-pyran-2-yl)ethyl)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-1-naphthalenyl ester
  • Dehydrosimvastatin
  • Simvastatin impurity, anhydro simvastatin- [USP]
  • Simvastatin specified impurity C [EP]
  • UNII-3Z35AA0H0B

Registry Numbers

CAS Registry Number

  • 210980-68-0

System Generated Number

  • 0210980680

Structure Descriptors

InChI

1S/C25H36O4/c1-6-25(4,5)24(27)29-21-15-16(2)14-18-11-10-17(3)20(23(18)21)13-12-19-8-7-9-22(26)28-19/h7,9-11,14,16-17,19-21,23H,6,8,12-13,15H2,1-5H3/t16-,17-,19-,20-,21-,23-/m0/s1

InChIKey

BIYWBTKPNWCYHM-RLSQPJRHSA-N

Smiles

CCC(C)(C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3CC=CC(=O)O3)C