Name: | GYPSOGENIN-3-GLUCORONIDE |
CAS: | 105762-16-1 |
Synonyms: | GYPSOGENIN GLUCORONIDE ; GYPSOGENIN-3-GLUCORONIDE |
MDL.: | MFCD00189422 |
H bond acceptor: | 10 |
H bond donor: | 5 |
Smile: | CC1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC([C@@]5(C)C=O)OC(=O)[C@@H]6[C@H]([C@@H]([C@H]([C@@H](O6)O)O)O)O)C)C)[C@@H]2C1)C)C(=O)O)C |
InChi: | InChI=1S/C36H54O10/c1-31(2)13-15-36(30(43)44)16-14-34(5)19(20(36)17-31)7-8-22-32(3)11-10-23(33(4,18-37)21(32)9-12-35(22,34)6)45-29(42)27-25(39)24(38)26(40)28(41)46-27/h7,18,20-28,38-41H,8-17H2,1-6H3,(H,43,44)/t20-,21+,22+,23?,24-,25-,26+,27-,28+,32-,33-,34+,35+,36-/m0/s1 |
InChiKey: | InChIKey=RHNWBDNAUYZYPU-LJLUSGJRSA-N |
GYPSOGENIN-3-GLUCORONIDE
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