Chem
J-GLOBAL ID：200907016865587043   Nikkaji number：J1.601.951H

(7S,8S,25S)-2,8,12,17-Tetramethyl-13-vinyl-18-ethyl-25-(methoxycarbonyl)-25-hydroxy-26-oxo-7,8-dihydro-3,5-ethano-21H,23H-porphyrin-7-propionic acid

(7S,8S,25S)-2,8,12,17-テトラメチル-13-ビニル-18-エチル-25-(メトキシカルボニル)-25-ヒドロキシ-26-オキソ-7,8-ジヒドロ-3,5-エタノ-21H,23H-ポルフィリン-7-プロピオン酸
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： C35H36N4O6
Molecular formula furigana： C35-H36-N4-O6
Molecular weight： 608.695
InChI： InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/b22-12+,23-13-,24-12-,25-14-,26-13+,27-14-,31-30+/t17-,21-,35-/m0/s1
InChI key： TXOKSKCKTYISQV-CBIQLXRQSA-N
SMILES： CCC1=C(C)C2=N/C/1=C\c1[nH]c3/C(=C/4\N=C(/C=c\5/[nH]/c(=C/2)/c(c5C)C=C)[C@H]([C@@H]4CCC(=O)O)C)/[C@@](C(=O)c3c1C)(O)C(=O)OC
Systematic name  (1)：
  • (7S,8S,25S)-2,8,12,17-テトラメチル-13-ビニル-18-エチル-25-(メトキシカルボニル)-25-ヒドロキシ-26-オキソ-7,8-ジヒドロ-3,5-エタノ-21H,23H-ポルフィリン-7-プロピオン酸
Other name (1)：
  • (7S,8S,25S)-2,8,12,17-Tetramethyl-13-vinyl-18-ethyl-25-(methoxycarbonyl)-25-hydroxy-26-oxo-7,8-dihydro-3,5-ethano-21H,23H-porphyrin-7-propionic acid
Thsaurus map：
Thesaurus Map

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