Chem
J-GLOBAL ID：200907056441915735   Nikkaji number：J2.611.551E

α-Hydroxyhemin

α-ヒドロキシヘミン
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： C34H38N4O
Molecular formula furigana： C34-H38-N4-O
Molecular weight： 518.705
InChI： InChI=1S/C34H38N4O/c1-9-13-24-19(6)26-15-28-18(5)23(12-4)33(37-28)34(39)32-21(8)22(11-3)29(38-32)16-27-20(7)25(14-10-2)31(36-27)17-30(24)35-26/h11-12,15-17,36-37,39H,3-4,9-10,13-14H2,1-2,5-8H3/b26-15-,27-16-,28-15-,29-16-,30-17-,31-17-,34-32+,34-33+
InChI key： QDFGUPAKBPGUHI-WEQBWRTBSA-N
SMILES： CCCC1=C(C)/C/2=C/c3[nH]c(c(C=C)c3C)/C(=C/3\N=C(/C=c/4\[nH]/c(=C\C1=N2)/c(CCC)c4C)C(=C3C)C=C)/O
Systematic name  (4)：
  • 2,7,12,18-テトラメチル-3,8-ジビニル-13,17-ジプロピル-21H,23H-ポルフィリン-5-オール
  • 5-ヒドロキシ-2,7,12,18-テトラメチル-3,8-ジビニル-13,17-ジプロピル-21H,23H-ポルフィリン
  • 4,19-ジエテニル-5,9,15,20-テトラメチル-10,14-ジプロピル-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン-2-オール
  • 4,19-diethenyl-5,9,15,20-tetramethyl-10,14-dipropyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-ol
Other name (4)：
  • 2,7,12,18-Tetramethyl-3,8-divinyl-13,17-dipropyl-21H,23H-porphyrin-5-ol
  • 5-Hydroxy-2,7,12,18-tetramethyl-3,8-divinyl-13,17-dipropyl-21H,23H-porphyrin
  • α-ヒドロキシヘミン
  • α-Hydroxyhemin
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