InChIKey | WRVGURKARDSWNT-UHFFFAOYSA-N |
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Inchi | 1S/C33H32N2O8S2.C6H15N/c1-2-23(17-32-34(13-7-15-44(36,37)38)28-19-24-9-3-5-11-26(24)21-30(28)42-32)18-33-35(14-8-16-45(39,40)41)29-20-25-10-4-6-12-27(25)22-31(29)43-33;1-4-7(5-2)6-3/h3-6,9-12,17-22H,2,7-8,13-16H2,1H3,(H-,36,37,38,39,40,41);4-6H2,1-3H3 |
SMILES | C12C=C3C(C=CC=C3)=CC=1O/C(=C\C(\CC)=C\C1OC3C=C4C=CC=CC4=CC=3[N+]=1CCCS([O-])(=O)=O)/N2CCCS(=O)(=O)O.N(CC)(CC)CC |
LogP | 8.85250 |
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PSA | 166.66000 |
精确分子量 | 749.28000 |
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