input word = C00047762

Metabolite InformationStructural formula
Name Biyouyanagin B
Formula C31H38O4
Mw 474.2770097
CAS RN 1174170-62-7
C_ID C00047762 ,
InChIKey HPOOJUSGIAKESV-OBARYKNHNA-N
InChICode InChI=1S/C31H38O4/c1-7-29(6)18-34-28(33)31(29)27(32)26-24-23(20(4)13-11-12-19(2)3)17-16-21(5)25(24)30(26,35-31)22-14-9-8-10-15-22/h7-10,12,14-16,20,23-26H,1,11,13,17-18H2,2-6H3/t20-,23+,24-,25+,26-,29-,30-,31+/m0/s1
SMILES [C@H]12[C@H]([C@]3([C@@H]1C(=O)[C@@]1(O3)C(=O)OC[C@]1(C)C=C)c1ccccc1)C(=CC[C@@H]2[C@H](CCC=C(C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum chinense Ref.
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