input word = C00048090

Metabolite InformationStructural formula
Name Rubuside G
(-)-Rubuside G
Formula C36H56O9
Mw 632.39243339
CAS RN 1189131-78-9
C_ID C00048090 ,
InChIKey KGDLSCYYZVWTEV-CTFQRVQJNA-N
InChICode InChI=1S/C36H56O9/c1-18-10-13-36(31(43)45-30-28(41)27(40)26(39)22(17-37)44-30)15-14-34(6)20(25(36)19(18)2)8-9-24-33(5)16-21(38)29(42)32(3,4)23(33)11-12-35(24,34)7/h8-9,18-19,21-24,26-30,37-42H,10-17H2,1-7H3/t18-,19+,21-,22-,23+,24-,26-,27+,28-,29-,30+,33+,34-,35-,36+/m1/s1
SMILES C[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=C2[C@H]1C)C=C[C@@H]1[C@@]2(C)C[C@@H](O)[C@@H](O)C(C)(C)[C@@H]2CC[C@]13C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeRubus ellipticus var.obcordatus Ref.
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OrganismRubus ellipticus var.obcordatus
ReferenceLi,J.Nat.Prod.,72,(2009),1755