input word = C00047541

Metabolite InformationStructural formula
Name Pharboside C
(-)-Pharboside C
Formula C27H44O11
Mw 544.28836225
CAS RN 1152595-60-2
C_ID C00047541 ,
InChIKey JVEVLHMSSSKCCH-PAXRSTTQNA-N
InChICode InChI=1S/C27H44O11/c1-24-7-4-8-25(2,23(35)36-3)20(24)19(33)21(34)26-9-13(5-6-15(24)26)27(11-26,12-29)38-22-18(32)17(31)16(30)14(10-28)37-22/h13-22,28-34H,4-12H2,1-3H3/t13-,14-,15+,16-,17+,18-,19+,20+,21+,22+,24+,25-,26-,27+/m1/s1
SMILES COC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@H]4C[C@]3(C[C@@]4(CO)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H](O)[C@@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeConvolvulaceaePharbitis nil Ref.
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