Chem
J-GLOBAL ID：200907057822076094   Nikkaji number：J1.205.939F

2,3:12,13:17,18-Tris[1,3]butadieno-7,8-(2,3-[1,3]butadieno-1,3-butadiene-1,4-diyl)-21H,23H-porphyrin

2,3:12,13:17,18-トリス[1,3]ブタジエノ-7,8-(2,3-[1,3]ブタジエノ-1,3-ブタジエン-1,4-ジイル)-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： C40H24N4
Molecular formula furigana： C40-H24-N4
Molecular weight： 560.660
InChI： InChI=1S/C40H24N4/c1-2-10-24-18-32-31(17-23(24)9-1)39-21-37-29-15-7-5-13-27(29)35(42-37)19-33-25-11-3-4-12-26(25)34(41-33)20-36-28-14-6-8-16-30(28)38(43-36)22-40(32)44-39/h1-22,42-43H/b33-19-,34-20-,35-19-,36-20-,37-21-,38-22-,39-21-,40-22-
InChI key： WQUZRCXNRDUMOZ-UFRVCQEYSA-N
SMILES： c1ccc2C3=N/C(=C\c4[nH]c(/C=C/5\N=C(/C=c/6\[nH]/c(=C\3)/c3c6cccc3)c3c5cc5ccccc5c3)c3c4cccc3)/c2c1
Systematic name  (3)：
  • 2,3:12,13:17,18-トリス[1,3]ブタジエノ-7,8-(2,3-[1,3]ブタジエノ-1,3-ブタジエン-1,4-ジイル)-21H,23H-ポルフィリン
  • 41,42,43,44-テトラアザデカシクロ[28.10.1.13,10.112,19.121,28.04,9.013,18.022,27.031,40.033,38]テトラテトラコンタ-1,3,5,7,9,11,13,15,17,19(43),20,22,24,26,28,30(41),31,33,35,37,39-ヘンイコサエン
  • 41,42,43,44-tetraazadecacyclo[28.10.1.13,10.112,19.121,28.04,9.013,18.022,27.031,40.033,38]tetratetraconta-1,3,5,7,9,11,13,15,17,19(43),20,22,24,26,28,30(41),31,33,35,37,39-henicosaene
Other name (1)：
  • 2,3:12,13:17,18-Tris[1,3]butadieno-7,8-(2,3-[1,3]butadieno-1,3-butadiene-1,4-diyl)-21H,23H-porphyrin
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Thesaurus Map

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