SENNOSIDE B CALCIUM SALT ,52730-37-7

SENNOSIDE B CALCIUM SALT

Basic Information
Product Name：	SENNOSIDE B CALCIUM SALT
CAS：	52730-37-7
English Synonyms：	SENNOSIDE B CALCIUM SALT
MDL Number.：	MFCD16621030
H bond acceptor：	20
H bond donor：	10
Smile：	c1cc2c(c(c1)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)C(=O)c4c5cc(cc4O)C(=O)O[Ca]OC(=O)c6cc7c(c(c6)O)C(=O)c8c(cccc8O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)[C@@H]7[C@@H]25
InChi：	InChI=1S/C42H38O20.Ca/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46;/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58);/q;+2/p-2/t23-,24-,25+,26+,31-,32-,35+,36+,37-,38-,41-,42-;/m1./s1
InChiKey：	InChIKey=JQVYZJIFFAHQKX-BBVKTMQASA-L

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