Name: Pyropheophorbide-a
Rating: 5 (10 reviews)

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类似物检索

HIT ID:HIT212686642
Cas No:24533-72-0
常用名:Pyropheophorbide-a
别名:焦脱镁叶绿酸-ALPHA, Ppa
IUPAC:3-[(21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetraazahexacyclo[18.2.1.1^{5,8}.1^{10,13}.1^{15,18}.0^{2,6}]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoic acid
IUPAC:3-[(21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetraazahexacyclo[18.2.1.1^{5,8}.1^{10,13}.1^{15,18}.0^{2,6}]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoic acid
InChI key:IEGUQQKIFBYXLG-CDIXLCFRSA-N

分子式:C33H34N4O3
分子量:534.66
氢键供体数 (HBD):3
氢键受体数 (HBA):5
LogP:5.8554363
SMILES:CCc1c(C)c2cc3[nH]c(cc4nc([C@@H](CCC(O)=O)[C@@H]4C)c4CC(=O)c5c(C)c(cc1n2)[nH]c45)c(C)c3C=C
SMILES:CCc1c(C)c2cc3[nH]c(cc4nc([C@@H](CCC(O)=O)[C@@H]4C)c4CC(=O)c5c(C)c(cc1n2)[nH]c45)c(C)c3C=C

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