guajavin A

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InChI :InChI=1/C56H38O32/c57-15-7-21-10(4-20(62)48(84-21)9-1-16(58)36(66)17(59)2-9)33(63)26(15)30-29-32-28(43(73)47(77)44(29)74)27-31-23(41(71)46(76)42(27)72)11-3-14(35(65)45(75)34(11)64)54(80)85-22-8-83-52(78)12-5-18(60)37(67)39(69)24(12)25-13(6-19(61)38(68)40(25)70)53(79)86-49(22)51(88-55(31)81)50(30)87-56(32)82/h1-3,5-7,20,22,30,48-51,57-77H,4,8H2
Std.InChI: InChI=1S/C56H38O32/c57-15-7-21-10(4-20(62)48(84-21)9-1-16(58)36(66)17(59)2-9)33(63)26(15)30-29-32-28(43(73)47(77)44(29)74)27-31-23(41(71)46(76)42(27)72)11-3-14(35(65)45(75)34(11)64)54(80)85-22-8-83-52(78)12-5-18(60)37(67)39(69)24(12)25-13(6-19(61)38(68)40(25)70)53(79)86-49(22)51(88-55(31)81)50(30)87-56(32)82/h1-3,5-7,20,22,30,48-51,57-77H,4,8H2
InChIKey :TVSNZNUKUFVIQS-UHFFFAOYAO
Std.InChIKey: TVSNZNUKUFVIQS-UHFFFAOYSA-N
SMILES :C1C(C(OC2=CC(=C(C(=C21)O)C3C4C5C6C(COC(=O)C7=CC(=C(C(=C7C8=C(C(=C(C=C8C(=O)O6)O)O)O)O)O)O)OC(=O)C9=C(C(=C(C(=C9)C1=C(C(=C(C(=C1O)O)O)C1=C(C3=C(C(=C1O)O)O)C(=O)O4)C(=O)O5)O)O)O)O)C1=CC(=C(C(=C1)O)O)O)O
Molar Refractivity :278.70 ± 0.3 cm3 (est)
Parachor :2099.1 ± 6.0 cm3 (est)
Index of Refraction :1.861 ± 0.02 (est)
Surface Tension :133.3 ± 3.0 dyne/cm (est)
Density :1.979 ± 0.06 g/cm3 (est)
Polarizability :110.48 ± 0.5 10-24cm3 (est)