Chem
J-GLOBAL ID:200907000488379550   Nikkaji number:J1.822.437B

7,18-Dimethyl-8,17-diethyl-2-oxo-2a-homo-2a,21-didehydro-2,24-dihydro-21H,23H-porphyrin

7,18-ジメチル-8,17-ジエチル-2-オキソ-2a-ホモ-2a,21-ジデヒドロ-2,24-ジヒドロ-21H,23H-ポルフィリン
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: C27H26N4O
Molecular formula furigana: C27-H26-N4-O
Molecular weight: 422.532
InChI: InChI=1S/C27H26N4O/c1-5-20-15(3)22-11-19-9-10-27(32)26(29-19)14-23-16(4)21(6-2)25(31-23)13-18-8-7-17(28-18)12-24(20)30-22/h7-14,28,31H,5-6H2,1-4H3/b17-12-,18-13-,19-11+,22-11-,23-14-,24-12-,25-13-,26-14+
InChI key: BOFKPGOYMKRGQR-WUQWYHITSA-N
SMILES: CCC1=C(C)C2=N/C/1=C\c1ccc(/C=c/3\[nH]/c(=C\C4=N/C(=C/2)/C=CC4=O)/c(c3CC)C)[nH]1
Systematic name  (3):
  • 7,18-ジメチル-8,17-ジエチル-2-オキソ-2a-ホモ-2a,21-ジデヒドロ-2,24-ジヒドロ-21H,23H-ポルフィリン
  • 5,14-ジエチル-4,15-ジメチル-22,23,24,25-テトラアザペンタシクロ[16.3.1.13,6.18,11.113,16]ペンタコサ-1,3(25),4,6,8,10,12,14,16,18(22),20-ウンデカエン-19-オン
  • 5,14-diethyl-4,15-dimethyl-22,23,24,25-tetraazapentacyclo[16.3.1.13,6.18,11.113,16]pentacosa-1,3(25),4,6,8,10,12,14,16,18(22),20-undecaen-19-one
Other name (1):
  • 7,18-Dimethyl-8,17-diethyl-2-oxo-2a-homo-2a,21-didehydro-2,24-dihydro-21H,23H-porphyrin
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