input word = C00047539

Metabolite InformationStructural formula
Name Pharboside A
(-)-Pharboside A
Formula C26H40O8
Mw 480.27231825
CAS RN 1152595-54-4
C_ID C00047539 ,
InChIKey TUMAVTPFEIQOKS-OJTAZIFWNA-N
InChICode InChI=1S/C26H40O8/c1-13-10-26-11-14(13)5-6-16(26)24(2)7-4-8-25(3,17(24)9-18(26)28)23(32)34-22-21(31)20(30)19(29)15(12-27)33-22/h14-22,27-31H,1,4-12H2,2-3H3/t14-,15-,16+,17+,18+,19-,20+,21-,22+,24+,25-,26+/m1/s1
SMILES C1[C@@H]2[C@]3(C[C@@H](C1)C(=C)C3)[C@H](C[C@H]1[C@]2(CCC[C@]1(C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConvolvulaceaePharbitis nil Ref.
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