chrodrimanin C
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InChI :InChI=1/C25H32O5/c1-13-10-15-14-11-19-24(4)8-7-20(27)23(2,3)18(24)6-9-25(19,5)30-17(14)12-16(26)21(15)22(28)29-13/h12-13,18-19,26H,6-11H2,1-5H3/t13-,18+,19+,24+,25+/m1/s1
Std.InChI: InChI=1S/C25H32O5/c1-13-10-15-14-11-19-24(4)8-7-20(27)23(2,3)18(24)6-9-25(19,5)30-17(14)12-16(26)21(15)22(28)29-13/h12-13,18-19,26H,6-11H2,1-5H3/t13-,18+,19+,24+,25+/m1/s1
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InChIKey :CFWQLQINZAVWGP-IZCXAEKABW
Std.InChIKey: CFWQLQINZAVWGP-IZCXAEKASA-N
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SMILES :C[C@@H]1Cc2c3c(cc(c2C(=O)O1)O)O[C@]4(CC[C@@H]5[C@@]([C@@H]4C3)(CCC(=O)C5(C)C)C)C
Molar Refractivity :112.20 ± 0.3 cm3 (est)
Parachor :890.5 ± 6.0 cm3 (est)
Index of Refraction :1.557 ± 0.02 (est)
Surface Tension :42.6 ± 3.0 dyne/cm (est)
Density :1.183 ± 0.06 g/cm3 (est)
Polarizability :44.47 ± 0.5 10-24cm3 (est)