InChI=1S/C28H24O16/c29-8-18-21(37)23(39)26(43-27(40)10-4-15(34)20(36)16(35)5-10)28(42-18)44-25-22(38)19-14(33)6-11(30)7-17(19)41-24(25)9-1-2-12(31)13(32)3-9/h1-7,18,21,23,26,28-37,39H,8H2/t18-,21+,23+,26-,28+/m1/s1

【InChIKey】

InChIKey=PXGWEUQZDRUMRE-UNZYZCBSSA-N

【SMILES】

c1cc(c(cc1c2c(c(=O)c3c(cc(cc3o2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)OC(=O)c5cc(c(c(c5)O)O)O)O)O

【MOL File】

2'-O-GALLOYLHYPERIN.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:10

H bond acceptor:16

XLogP3:0.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

2'-O-GALLOYLHYPERIN.cml

Quick Release

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53209-27-1 2'-O-GALLOYLHYPERIN

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】