UROPORPHYRIN I DIHYDROCHLORIDE

CAS No.
68929-06-6
CCD No.
CCD00039125
Formula
C40 H38 N4 O16 . 2 Cl H
MolWeight
903.674

Basic Information

Product Name: UROPORPHYRIN I DIHYDROCHLORIDE
CAS: 68929-06-6
English Synonyms: UROPORPHYRIN I DIHYDROCHLORIDE
MDL Number.: MFCD00058110
H bond acceptor: 20
H bond donor: 10
Smile: c1\c2c(c(c([nH]2)/cc/3\nc(/cc\4/c(c(/c(/[nH]4)c/c5n/c1/C(=C5CCC(=O)O)CC(=O)O)CC(=O)O)CCC(=O)O)C(=C3CCC(=O)O)CC(=O)O)CC(=O)O)CCC(=O)O.Cl.Cl
InChi: InChI=1S/C40H38N4O16.2ClH/c45-33(46)5-1-17-21(9-37(53)54)29-14-26-19(3-7-35(49)50)23(11-39(57)58)31(43-26)16-28-20(4-8-36(51)52)24(12-40(59)60)32(44-28)15-27-18(2-6-34(47)48)22(10-38(55)56)30(42-27)13-25(17)41-29;;/h13-16,41,44H,1-12H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60);2*1H/b25-13-,26-14-,27-15-,28-16-,29-14-,30-13-,31-16-,32-15-;;
InChiKey: InChIKey=DZLKLVAJOHLPKP-ARSPAUKVSA-N

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