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Strictinin
[CAS# 517-46-4]

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CAS#: 517-46-4
Product: Strictinin
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Identification
Name Strictinin
Synonyms Strictinin; Beta-D-Glucopyranose, Cyclic 4,6-(4,4',5,5',6,6'-Hexahydroxy(1,1'-Biphenyl)-2,2'-Dicarboxylate) 1-(3,4,5-Trihydroxybenzoate), Stereooisomer; .Beta.-D-Glucopyranose, Cyclic 4,6-(4,4',5,5',6,6'-Hexahydroxy(1,1'-Biphenyl)-2,2'-Dicarboxylate)-1-(3,4,5-Trihydroxybenzoate), Stereoisomer
Molecular Structure CAS#: 517-46-4, Strictinin
Molecular Formula C27H22O18
Molecular Weight 634.46
CAS Registry Number 517-46-4
SMILES [C@@H]24OC(=O)C5=C(C1=C(O)C(=C(O)C=C1C(OC[C@H]2O[C@@H](OC(=O)C3=CC(=C(O)C(=C3)O)O)[C@H](O)[C@H]4O)=O)O)C(=C(O)C(=C5)O)O
InChI 1S/C27H22O18/c28-9-1-6(2-10(29)16(9)32)24(39)45-27-22(38)21(37)23-13(43-27)5-42-25(40)7-3-11(30)17(33)19(35)14(7)15-8(26(41)44-23)4-12(31)18(34)20(15)36/h1-4,13,21-23,27-38H,5H2/t13-,21-,22-,23-,27+/m1/s1
InChIKey FYIJLTSMNXUNLT-CXQFPWCTSA-N
Properties
Density 2.11g/cm3 (Cal.)
Boiling point 1280.848°C at 760 mmHg (Cal.)
Flash point 418.789°C (Cal.)
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