scillirosidin
Molecular Formula:
C27H36O6
InChI: InChI=1/C27H36O6/c1-16(28)33-21-14-26(4)22(24(2)10-7-18(29)13-20(21)24)9-11-25(3)19(8-12-27(25,26)31)17-5-6-23(30)32-15-17/h5-6,13,15,18-19,21-22,29,31H,7-12,14H2,1-4H3/t18-,19+,21+,22+,24-,25+,26+,27+/m0/s1
InChIKey: InChIKey=JZQJHFOODDAZNV-RKIKRYHGBX
SMILES: [H][C@@]1(CC[C@@]2(O)[C@]1(C)CC[C@]3([H])[C@@]4(C)CC[C@H](O)C=C4[C@@H](C[C@@]23C)OC(C)=O)C5=COC(=O)C=C5
Names:
CHEBI:37417
Scillirosidin
scillirosidin
507-59-5
6beta-acetoxy-3beta,8alpha,14-trihydroxybufa-4,20,22-trienolide
[(3S,6R,8R,9R,10R,13R,14R,17S)-3,14-dihydroxy-8,10,13-trimethyl-17-(6-oxopyran-3-yl)-2,3,6,7,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-yl] acetate
Registries:
PubChem CID 11966227
ChEBI 37417
PubChem ID 17425180
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