Chem
J-GLOBAL ID：200907016754212237
Nikkaji number：J1.639.075E
5-Formyl-17-nitro-25,27-dipropoxy-26,28-bis(ethoxycarbonylmethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene
5-ホルミル-17-ニトロ-25,27-ジプロポキシ-26,28-ビス(エトキシカルボニルメトキシ)ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン
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
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
Molecular formula： C43H47[N+]O10[O-]
Molecular formula furigana： C43-H47-N-O11
Molecular weight： 753.845
InChI：
InChI=1S/C43H47NO11/c1-5-15-52-40-29-11-9-13-31(40)21-35-23-37(44(48)49)24-36(43(35)55-27-39(47)51-8-4)22-32-14-10-12-30(41(32)53-16-6-2)20-34-18-28(25-45)17-33(19-29)42(34)54-26-38(46)50-7-3/h9-14,17-18,23-25H,5-8,15-16,19-22,26-27H2,1-4H3
InChI key：
WOCYHIPHDBQKAI-UHFFFAOYSA-N
SMILES：
CCCOc1c2Cc3cc(C=O)cc(Cc4cccc(Cc5cc(cc(Cc1ccc2)c5OCC(=O)OCC)[N+](=O)[O-])c4OCCC)c3OCC(=O)OCC
Systematic name (4)：
- 17-ニトロ-25,27-ジプロポキシ-26,28-ビス(エトキシカルボニルメトキシ)ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-5-カルボアルデヒド
- 5-ホルミル-17-ニトロ-25,27-ジプロポキシ-26,28-ビス(エトキシカルボニルメトキシ)ペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン
- エチル 2-{[27-(2-エトキシ-2-オキソエトキシ)-23-ホルミル-11-ニトロ-26,28-ジプロポキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25-イル]オキシ}アセタート
- ethyl 2-{[27-(2-ethoxy-2-oxoethoxy)-23-formyl-11-nitro-26,28-dipropoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaen-25-yl]oxy}acetate
- 17-Nitro-25,27-dipropoxy-26,28-bis(ethoxycarbonylmethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene-5-carbaldehyde
- 5-Formyl-17-nitro-25,27-dipropoxy-26,28-bis(ethoxycarbonylmethoxy)pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecene
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