CONVALLATOXOL ,3253-62-1 _Chemical Cloud Database

CONVALLATOXOL

Basic Information
Product Name：	CONVALLATOXOL
CAS：	3253-62-1
English Synonyms：	CONVALLATOXOL
MDL Number.：	MFCD00056527
H bond acceptor：	10
H bond donor：	6
Smile：	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)CO)O)O)O
InChi：	InChI=1S/C29H44O10/c1-15-22(32)23(33)24(34)25(38-15)39-17-3-8-27(14-30)19-4-7-26(2)18(16-11-21(31)37-13-16)6-10-29(26,36)20(19)5-9-28(27,35)12-17/h11,15,17-20,22-25,30,32-36H,3-10,12-14H2,1-2H3/t15-,17-,18+,19-,20+,22-,23+,24+,25-,26+,27-,28-,29-/m0/s1
InChiKey：	InChIKey=UQEKVLJMBGSQGS-JQKSAQOKSA-N

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