Chem
J-GLOBAL ID:201107076727668700   Nikkaji number:J2.946.469C

(4R,15S)-8-Methoxy-12,14-dioxo-13-phenyl-3-oxa-1,11,13-triazatetracyclo[9.3.1.04,15.05,10]pentadecane-5,7,9-triene-2,2-bis(acetic acid ethyl) ester

(4R,15S)-8-メトキシ-12,14-ジオキソ-13-フェニル-3-オキサ-1,11,13-トリアザテトラシクロ[9.3.1.04,15.05,10]ペンタデカン-5,7,9-トリエン-2,2-ビス(酢酸エチル)
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: C26H27N3O8
Molecular formula furigana: C26-H27-N3-O8
Molecular weight: 509.515
InChI: InChI=1S/C26H27N3O8/c1-4-35-20(30)14-26(15-21(31)36-5-2)29-23-22(37-26)18-12-11-17(34-3)13-19(18)28(23)24(32)27(25(29)33)16-9-7-6-8-10-16/h6-13,22-23H,4-5,14-15H2,1-3H3/t22-,23+/m1/s1
InChI key: NCVJNVCVSAXBCY-PKTZIBPZSA-N
SMILES: CCOC(=O)CC1(CC(=O)OCC)O[C@H]2[C@H]3N(c4cc(OC)ccc24)C(=O)N(C(=O)N13)c1ccccc1
Systematic name  (3):
  • (4R,15S)-8-メトキシ-12,14-ジオキソ-13-フェニル-3-オキサ-1,11,13-トリアザテトラシクロ[9.3.1.04,15.05,10]ペンタデカン-5,7,9-トリエン-2,2-ビス(酢酸エチル)
  • エチル 2-[(8R,15S)-10-(2-エトキシ-2-オキソエチル)-4-メトキシ-12,14-ジオキソ-13-フェニル-9-オキサ-1,11,13-トリアザテトラシクロ[6.6.1.02,7.011,15]ペンタデカ-2,4,6-トリエン-10-イル]アセタート
  • ethyl 2-[(8R,15S)-10-(2-ethoxy-2-oxoethyl)-4-methoxy-12,14-dioxo-13-phenyl-9-oxa-1,11,13-triazatetracyclo[6.6.1.02,7.011,15]pentadeca-2,4,6-trien-10-yl]acetate
Other name (1):
  • (4R,15S)-8-Methoxy-12,14-dioxo-13-phenyl-3-oxa-1,11,13-triazatetracyclo[9.3.1.04,15.05,10]pentadecane-5,7,9-triene-2,2-bis(acetic acid ethyl) ester
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