RADDEANIN A ,89412-79-3 _Chemical Cloud Database

RADDEANIN A

Basic Information
Product Name：	RADDEANIN A
CAS：	89412-79-3
English Synonyms：	ANEMODEANIN A ; 3-[[6-DEOXYHEXOPYRANOSYL-(1->2)HEXOPYRANOSYL-(1->2)PENTOPYRANOSYL]OXY]OLEAN-12-EN-28-OIC ACID ; RADDEANIN A
MDL Number.：	MFCD10566637
H bond acceptor：	16
H bond donor：	9
Smile：	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@@H]3[C@H]([C@H](CO[C@H]3O[C@H]4CC[C@]5([C@H](C4(C)C)CC[C@@]6([C@@H]5CC=C7[C@]6(CC[C@@]8([C@H]7CC(CC8)(C)C)C(=O)O)C)C)C)O)O)CO)O)O)O)O)O
InChi：	InChI=1S/C47H76O16/c1-22-30(50)33(53)35(55)38(59-22)62-37-34(54)32(52)26(20-48)60-40(37)63-36-31(51)25(49)21-58-39(36)61-29-12-13-44(6)27(43(29,4)5)11-14-46(8)28(44)10-9-23-24-19-42(2,3)15-17-47(24,41(56)57)18-16-45(23,46)7/h9,22,24-40,48-55H,10-21H2,1-8H3,(H,56,57)/t22-,24-,25-,26+,27-,28+,29-,30-,31-,32+,33+,34-,35+,36+,37+,38-,39-,40-,44-,45+,46+,47-/m0/s1
InChiKey：	InChIKey=VQQGPFFHGWNIGX-PPCHTBMASA-N
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