Chemical Formula: | C46H44N2O6 |
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Molecular Weight: | 720.85 |
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Synonyms: | 2-(1-Carboxy-2-phenylethyl)-9-(1-hexylheptyl)anthradiisoquinoline-1,3,8,10(2H,9H)-tetraone; 3-phenyl-2-(6,8,17,19-tetraoxo-18-tridecan-7-yl-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaen-7-yl)propanoic acid |
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MDL No.: | N/A |
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EINECS / EC No.: | N/A |
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Pubchem CID: | 101578376 |
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IUPAC Name: | 3-phenyl-2-(6,8,17,19-tetraoxo-18-tridecan-7-yl-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaen-7-yl)propanoic acid |
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Standard InchI: | InChI=1S/C46H44N2O6/c1-3-5-7-12-16-28(17-13-8-6-4-2)47-42(49)33-22-18-29-31-20-24-35-41-36(25-21-32(39(31)41)30-19-23-34(43(47)50)40(33)38(29)30)45(52)48(44(35)51)37(46(53)54)26-27-14-10-9-11-15-27/h9-11,14-15,18-25,28,37H,3-8,12-13,16-17,26H2,1-2H3,(H,53,54) |
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InchI Key: | BBKHHDROLQEEMN-UHFFFAOYSA-N |
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SMILES: | CCCCCCC(CCCCCC)N1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C6C4=CC=C7C6=C(C=C5)C(=O)N(C7=O)C(CC8=CC=CC=C8)C(=O)O)C1=O |
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Appearance: | - |
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Melting Point: | N/A |
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Boiling Point: | N/A |
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Density (Theoretical): | N/A |
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