9a-Hydroxy Ramipril Diketopiperazine - CAS 1309040-96-7

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Catalog Number: R058617

CAS Number: 1309040-96-7

PubChem Substance ID:355141570

Molecular Formula: C23H30N2O5

Molecular Weight:414.502

Purity: ≥95%

* For research use only. Not for human or veterinary use.

Synonym

Synonyms(αS,3S,5aS,8aS,9aS)-Decahydro-9a-hydroxy-3-methyl-1,4-dioxo-α-(2-phenylethyl)-2H-cyclopenta[4,5]pyrrolo[1,2-a]pyrazine-2-acetic Acid Ethyl Ester;

Property

Molecular Formula: C23H30N2O5
Molecular Weight414.502
Purity≥95%
Storage-20°C

Computed Descriptor

IUPAC Nameethyl (2S)-2-[(2S,4aS,5aS,8aS)-4a-hydroxy-2-methyl-1,4-dioxo-5,5a,6,7,8,8a-hexahydro-2H-cyclopenta[3,4]pyrrolo[3,5-a]pyrazin-3-yl]-4-phenylbutanoate
InChIInChI=1S/C23H30N2O5/c1-3-30-21(27)19(13-12-16-8-5-4-6-9-16)24-15(2)20(26)25-18-11-7-10-17(18)14-23(25,29)22(24)28/h4-6,8-9,15,17-19,29H,3,7,10-14H2,1-2H3/t15-,17-,18-,19-,23-/m0/s1
InChIKeyVLBAUIKFYUTIDF-PXMVHEFSSA-N
SMILESCCOC(=O)C(CCC1=CC=CC=C1)N2C(C(=O)N3C4CCCC4CC3(C2=O)O)C