Cornusiin A
[CAS# 95263-69-7]

Identification

• Name: Cornusiin A
• Synonyms: D-Glucose, Cyclic 4-2':6-2-(4-(6-Carboxy-2,3,4-Trihydroxyphenoxy)-4',5,5',6,6'-Pentahydroxy(1,1'-Biphenyl)-2,2'-Dicarboxylate) 2,3-Bis(3,4,5-Trihydroxybenzoate), 2-Ester With D-Glucose Cyclic 4,6-(4,4',5',5',6,6'-Hexahydroxy(1,1'-Biphenyl)-2,2'-Dicarboxyl
• Molecular Formula: C₆₈H₅₀O₄₄
• Molecular Weight: 1571.12
• CAS Registry Number: 95263-69-7
• SMILES: C1=C(C(=C(C2=C1C(OCC(C(OC(C3=C2C(=C(C(=C3)O)O)O)=O)C(OC(C4=CC(=C(C(=C4)O)O)O)=O)C(OC(C5=CC(=C(C(=C5)O)O)O)=O)C=O)O)=O)O)O)OC%10=C(C(OC(C(C6OC(C8=C(C7=C(C(OCC6O)=O)C=C(C(=C7O)O)O)C(=C(C(=C8)O)O)O)=O)OC(C9=CC(=C(C(=C9)O)O)O)=O)C=O)=O)C=C(C(=C%10O)O)O
• InChI: 1S/C68H50O44/c69-12-37(107-61(96)16-1-24(71)43(83)25(72)2-16)59(111-62(97)17-3-26(73)44(84)27(74)4-17)57-35(82)15-105-65(100)22-11-36(50(90)54(94)42(22)41-21(67(102)109-57)9-32(79)48(88)53(41)93)106-56-23(10-33(80)49(89)55(56)95)68(103)108-38(13-70)60(112
• InChIKey: CGTQPVKZNROYFH-UHFFFAOYSA-N

Properties

• Density: 1.899g/cm³ (Cal.)