3,3',3'',3'''-{(7S,8S,12S,13S)-3,8,13,17-Tetrakis[(¹³C,¹⁸O₂)carboxymethyl]-8,13-dimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl}tetra(1-¹³C)propan(¹⁸O₂)oic acid

SMILES:

CC1(C(C2=CC3=NC(=Cc4c(c(c([nH]4)Cc5c(c(c([nH]5)C=C1N2)CC(=O)O)CCC(=O)O)CCC(=O)O)CC(=O)O)C(C3(C)CC(=O)O)CCC(=O)O)CCC(=O)O)CC(=O)O CopyCopied

Std. InChI:

InChI=1S/C42H48N4O16/c1-41(17-39(59)60)23(5-9-35(51)52)29-14-27-21(11-37(55)56)19(3-7-33(47)48)25(43-27)13-26-20(4-8-34(49)50)22(12-38(57)58)28(44-26)15-31-42(2,18-40(61)62)24(6-10-36(53)54)30(46-31)16-32(41)45-29/h14-16,23-24,43-44,46H,3-13,17-18H2,1-2H3,(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)/b29-14-,30-16-,31-15-/t23-,24-,41+,42+/m1/s1/i33+1,34+1,35+1,36+1,37+1,38+1,39+1,40+1,47+2,48+2,49+2,50+2,51+2,52+2,53+2,54+2,55+2,56+2,57+2,58+2,59+2,60+2,61+2,62+2 CopyCopied

Std. InChIKey:

CSWLXNNNLVVXKD-CBLAUILHSA-N CopyCopied

CSID:8548982, http://www.chemspider.com/Chemical-Structure.8548982.html (accessed 04:45, May 26, 2012) CopyCopied