Chem
J-GLOBAL ID：200907032959253942   Nikkaji number：J545.631B

(3S,4R,4aS,6′S,7R)-Decahydro-1-oxo-7-(2-hydroxyethyl)-6′-methylspiro[pyrrolo[1,2-c]pyrimidine-3(4H),2′-[2H]pyran]-4-carboxylic acid methyl ester

(3S,4R,4aS,6′S,7R)-デカヒドロ-1-オキソ-7-(2-ヒドロキシエチル)-6′-メチルスピロ[ピロロ[1,2-c]ピリミジン-3(4H),2′-[2H]ピラン]-4-カルボン酸メチル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C16H26N2O5
Molecular formula furigana： C16-H26-N2-O5
Molecular weight： 326.393
InChI： InChI=1S/C16H26N2O5/c1-10-4-3-8-16(23-10)13(14(20)22-2)12-6-5-11(7-9-19)18(12)15(21)17-16/h10-13,19H,3-9H2,1-2H3,(H,17,21)/t10-,11+,12-,13-,16-/m0/s1
InChI key： CXADZLQNUTXPET-AWYNBESOSA-N
SMILES： COC(=O)[C@@H]1[C@@H]2CC[C@H](CCO)N2C(=O)N[C@@]21CCC[C@H](C)O2
Systematic name  (3)：
  • (3S,4R,4aS,6′S,7R)-デカヒドロ-1-オキソ-7-(2-ヒドロキシエチル)-6′-メチルスピロ[ピロロ[1,2-c]ピリミジン-3(4H),2′-[2H]ピラン]-4-カルボン酸メチル
  • メチル (2S,4'R,4'aS,6S,7'R)-7'-(2-ヒドロキシエチル)-6-メチル-1'-オキソ-ヘキサヒドロ-1'H-スピロ[オキサン-2,3'-ピロロ[1,2-c]ピリミジン]-4'-カルボキシラート
  • methyl (2S,4'R,4'aS,6S,7'R)-7'-(2-hydroxyethyl)-6-methyl-1'-oxo-hexahydro-1'H-spiro[oxane-2,3'-pyrrolo[1,2-c]pyrimidine]-4'-carboxylate
Other name (1)：
  • (3S,4R,4aS,6′S,7R)-Decahydro-1-oxo-7-(2-hydroxyethyl)-6′-methylspiro[pyrrolo[1,2-c]pyrimidine-3(4H),2′-[2H]pyran]-4-carboxylic acid methyl ester
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