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Tetrapyrroles and derivatives

Description:

Polycyclic aromatic compounds containing four pyrrole rings joined by one-carbon units linking position 2 of one pyrrole ring to position 5 of the next.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Tetrapyrroles and derivatives
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Items 13-24 of 113

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  1. tin protoporphyrin IX
    Cas Number: 110020-43-4        Compound CID:  73755113
    IUPAC Name:  tin(4+) ion 10,14-bis(2-carboxyethyl)-4,19-diethenyl-5,9,15,20-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1^{3,6}.1^{8,11}.1^{13,16}]tetracosa-show more
    SMILES:  C=Cc1c2/C=c/3\[n-]c(=Cc4[n-]c(/C=c/5\[n-]/c(=C\c(c1C)[n-]2)/c(C=C)c5C)c(c4CCC(=O)O)C)c(c3C)CCC(=O)O.[Sn+4]
    InChIKey: VWEYNEFKXXWVHZ-IBPJAKCHSA-N
    InChI:  InChI=1S/C34H32N4O4.Sn/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)show more
    Synonyms: Sn Protoporphyrin | tin(4+) ion 10,14-bis(2-carboxyethyl)-4,19-diethenyl-5,9,15,20-tetramethyl-21,22,23,24-tetraazape...
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  2. heme
    Cas Number: 14875-96-8        Compound CID:  26945
    Formula:  C34H32FeN4O4²        Molecular Weight: 616.49
    IUPAC Name:  3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoic acid;iron(2+)
    SMILES:  CC1=C(C2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1[N-]2)C)C=C)C)C=C)C)CCC(=O)O)CCC(=O)O.[Fe+2]
    InChIKey: KABFMIBPWCXCRK-UHFFFAOYSA-L
    InChI:  InChI=1S/C34H34N4O4.Fe/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)show more
    Synonyms: Ferrous protoheme | heme b | HEME IRON | Ferrate(2-), (7,12-diethenyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dip...
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  3. Cyanocobalamin
    Cas Number: 68-19-9        EC Number: 200-680-0        Compound CID:  5311498
    Formula:  C63H88CoN14O14P        Molecular Weight: 1355.37
    IUPAC Name:  cobalt(3+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(1R,2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18show more
    SMILES:  CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)([O-])OC(C)CNC(=O)CCC4(C(C5C6(C(C(C(=C(C7=NC(=CC8=NC(=C(C4=N5)C)C(C8(C)C)CCC(=O)N)C(C7(C)CC(=O)N)CCC(=O)N)Cshow more
    InChIKey: FDJOLVPMNUYSCM-WZHZPDAFSA-L
    InChI:  InChI=1S/C62H90N13O14P.CN.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)8show more
    Synonyms: CCG-220433 | Q55167869 | vitamin B12 | CAS-68-19-9 | HMS3713G08 | Cyanocob(III)alamin | HMS1569G08 | Cyanocobalamin;C...
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  4. Cyanocobalamin
    Cas Number: 68-19-9        EC Number: 200-680-0        Compound CID:  5311498
    Formula:  C63H88CoN14O14P        Molecular Weight: 1355.37
    IUPAC Name:  cobalt(3+);[(2R,3S,4R,5S)-5-(5,6-dimethylbenzimidazol-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] [(2R)-1-[3-[(1R,2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18show more
    SMILES:  CC1=CC2=C(C=C1C)N(C=N2)C3C(C(C(O3)CO)OP(=O)([O-])OC(C)CNC(=O)CCC4(C(C5C6(C(C(C(=C(C7=NC(=CC8=NC(=C(C4=N5)C)C(C8(C)C)CCC(=O)N)C(C7(C)CC(=O)N)CCC(=O)N)Cshow more
    InChIKey: FDJOLVPMNUYSCM-WZHZPDAFSA-L
    InChI:  InChI=1S/C62H90N13O14P.CN.Co/c1-29-20-39-40(21-30(29)2)75(28-70-39)57-52(84)53(41(27-76)87-57)89-90(85,86)88-31(3)26-69-49(83)18-19-59(8)37(22-46(66)8show more
    Synonyms: CCG-220433 | Q55167869 | vitamin B12 | CAS-68-19-9 | HMS3713G08 | Cyanocob(III)alamin | HMS1569G08 | Cyanocobalamin;C...
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  5. Deuteroporphyrin IX dimethyl ester from bovine blood
    Cas Number: 10589-94-3        Compound CID:  95097
    Formula:  C32H34N4O4        Molecular Weight: 538.64
    IUPAC Name:  methyl 3-[18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
    SMILES:  CC1=CC2=CC3=C(C=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C
    InChIKey: CEPCOHFDZYMQHP-UHFFFAOYSA-N
    InChI:  InChI=1S/C32H34N4O4/c1-17-11-22-14-27-19(3)23(7-9-31(37)39-5)29(35-27)16-30-24(8-10-32(38)40-6)20(4)28(36-30)15-26-18(2)12-21(34-26)13-25(17)33-22/h11show more
    Synonyms: SCHEMBL1283763 | 21H,23H-Porphine-2,18-dipropanoic acid, 3,7,12,17-tetramethyl-, dimethyl ester | Deuteroporphyrin IX...
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  6. Indium(III) phthalocyanine chloride
      Grade & Purity: 
    • Dye content 90 %
    Cas Number: 19631-19-7        Compound CID:  16684919
    Formula:  C32H16ClInN8       
    IUPAC Name:  38-chloro-9,18,27,36,37,39,40,41-octaza-38-indadecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15show more
    SMILES:  C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C6N4[In](N7C(=NC2=N3)C8=CC=CC=C8C7=NC9=NC(=N6)C1=CC=CC=C19)Cl
    InChIKey: AHXBXWOHQZBGFT-UHFFFAOYSA-M
    InChI:  InChI=1S/C32H16N8.ClH.In/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27show more
    Synonyms: AKOS015911861 | 2,11,20,29,37,39-Hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36...
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  7. Indium(III) phthalocyanine chloride
      Grade & Purity: 
    • Dye content 95 %
    Cas Number: 19631-19-7        Compound CID:  16684919
    Formula:  C32H16ClInN8       
    IUPAC Name:  38-chloro-9,18,27,36,37,39,40,41-octaza-38-indadecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15show more
    SMILES:  C1=CC=C2C(=C1)C3=NC4=C5C=CC=CC5=C6N4[In](N7C(=NC2=N3)C8=CC=CC=C8C7=NC9=NC(=N6)C1=CC=CC=C19)Cl
    InChIKey: AHXBXWOHQZBGFT-UHFFFAOYSA-M
    InChI:  InChI=1S/C32H16N8.ClH.In/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27show more
    Synonyms: AKOS015911861 | 2,11,20,29,37,39-Hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36...
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  8. Mesoporphyrin IX dimethyl ester
    Cas Number: 1263-63-4        Compound CID:  79151
    Formula:  C36H42N4O4        Molecular Weight: 594.74
    IUPAC Name:  methyl 3-[8,13-diethyl-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
    SMILES:  CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C)CC)C
    InChIKey: CQKDGYMHYLBWTQ-UHFFFAOYSA-N
    InChI:  InChI=1S/C36H42N4O4/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(show more
    Synonyms: Mesoporphyrin ix dimethyl ester | 21H,23H-Porphine-2, 18-dipropanoic acid, 7,12-diethyl-3,8,13,17-tetramethyl-, dimet...
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  9. 5,9,14,18,23,27,32,36-Octabutoxy-2,3-naphthalocyanine
      Grade & Purity: 
    • Dye content 95%
    Cas Number: 105528-25-4
    Formula:  C80H90N8O8        Molecular Weight: 1291.62
    IUPAC Name:  5,12,18,25,31,38,44,51-octabutoxy-2,15,28,41,53,54,55,56-octazatridecacyclo[40.10.1.13,14.116,27.129,40.04,13.06,11.017,26.019,24.030,39.032,37.043,52show more
    SMILES:  CCCCOC1=C2C=CC=CC2=C(C3=C4NC(=C31)N=C5C6=C(C7=CC=CC=C7C(=C6C(=N5)N=C8C9=C(C1=CC=CC=C1C(=C9C(=NC1=NC(=N4)C2=C(C3=CC=CC=C3C(=C21)OCCCC)OCCCC)N8)OCCCC)OCshow more
    InChIKey: BFXKASLQHBYWIJ-UHFFFAOYSA-N
    InChI:  InChI=1S/C80H90N8O8/c1-9-17-41-89-65-49-33-25-26-34-50(49)66(90-42-18-10-2)58-57(65)73-81-74(58)86-76-61-62(70(94-46-22-14-6)54-38-30-29-37-53(54)69(6show more
    Synonyms: 5,9,14,18,23,27,32,36-Octabutoxynaphthalocyanine
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  10. 1,4,8,11,15,18,22,25-Octabutoxy-29H,31H-phthalocyanine
      Grade & Purity: 
    • Dye content 95%
    Cas Number: 116453-73-7
    Formula:  C64H82N8O8        Molecular Weight: 1091.38
    IUPAC Name:  5,8,14,17,23,26,32,35-octabutoxy-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,1show more
    SMILES:  CCCCOC1=C2C(=C(C=C1)OCCCC)C3=NC4=NC(=NC5=C6C(=CC=C(C6=C(N5)N=C7C8=C(C=CC(=C8C(=N7)N=C2N3)OCCCC)OCCCC)OCCCC)OCCCC)C9=C(C=CC(=C94)OCCCC)OCCCC
    InChIKey: KAPOSTKECKHKAP-UHFFFAOYSA-N
    InChI:  InChI=1S/C64H82N8O8/c1-9-17-33-73-41-25-26-42(74-34-18-10-2)50-49(41)57-65-58(50)70-60-53-45(77-37-21-13-5)29-30-46(78-38-22-14-6)54(53)62(67-60)72-64show more
    Synonyms: 1,4,8,11,15,18,22,25-Octabutoxy-29H,31H-phthalocyanine | 1,4,8,11,15,18,22,25-Octabutoxy-29H,31H-phthalocyanine, Dye ...
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  11. Ni(II) Octaethylporphine
      Grade & Purity: 
    • ≥97%
    Cas Number: 24803-99-4        Compound CID:  526506
    Formula:  C36H44N4Ni        Molecular Weight: 591.45
    IUPAC Name:  nickel(2+);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide
    SMILES:  CCC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)CC)CC)CC)CC)C(=C3CC)CC)CC.[Ni+2]
    InChIKey: DIGQQRGHPATISA-UHFFFAOYSA-N
    InChI:  InChI=1S/C36H44N4.Ni/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;/hshow more
    Synonyms: 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine nickel(II) | 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphinenickel(II) ...
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  12. Protoporphyrin IX disodium salt
      Grade & Purity: 
    • ≥90%(HPLC)
    Cas Number: 50865-01-5        Compound CID:  71484
    Formula:  C34H32N4Na2O4        Molecular Weight: 606.63
    IUPAC Name:  disodium;3-[18-(2-carboxylatoethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
    SMILES:  CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)C=C)C)C(=C4CCC(=O)[O-])C)C(=C3C)CCC(=O)[O-])C=C.[Na+].[Na+]
    InChIKey: GPRXGEKBQVXWAQ-UHFFFAOYSA-L
    InChI:  InChI=1S/C34H34N4O4.2Na/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21show more
    Synonyms: SCHEMBL349121 | Protoporphyrin Disodium Salt | P-7660 | PROTOPORPHYRIN IX DISODIUM [MART.] | protoporphyrin disodiums...
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