Chem
J-GLOBAL ID：200907002340839520   Nikkaji number：J440.596J

(19R)-1-(2-Hydroxyacetyl)-17,19-epoxycuran 4-oxide

(19R)-1-(2-ヒドロキシアセチル)-17,19-エポキシクラン4-オキシド
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： C21H26N[N+]O3[O-]
Molecular formula furigana： C21-H26-N2-O4
Molecular weight： 370.449
InChI： InChI=1S/C21H26N2O4/c1-12-14-9-23(26)7-6-21-16-4-2-3-5-17(16)22(19(25)10-24)20(21)15(11-27-12)13(14)8-18(21)23/h2-5,12-15,18,20,24H,6-11H2,1H3/t12-,13+,14+,15-,18+,20+,21?,23?/m1/s1
InChI key： ZQMDAHUEILJWKN-DBCOXICMSA-N
SMILES： C[C@H]1OC[C@H]2[C@@H]3N(C(=O)CO)c4ccccc4C43CC[N+]3([O-])C[C@@H]1[C@@H]2C[C@@H]43
Systematic name  (3)：
  • (19R)-1-(2-ヒドロキシアセチル)-17,19-エポキシクラン4-オキシド
  • (12S,13R,16R,17S,18R,20S)-11-(2-ヒドロキシアセチル)-16-メチル-15-オキサ-1,11-ジアザヘキサシクロ[15.3.1.04,12.04,20.05,10.013,18]ヘンイコサ-5,7,9-トリエン-1-イウム-1-オラート
  • (12S,13R,16R,17S,18R,20S)-11-(2-hydroxyacetyl)-16-methyl-15-oxa-1,11-diazahexacyclo[15.3.1.04,12.04,20.05,10.013,18]henicosa-5,7,9-trien-1-ium-1-olate
Other name (1)：
  • (19R)-1-(2-Hydroxyacetyl)-17,19-epoxycuran 4-oxide
Thsaurus map：
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