input word = C00030496

Metabolite InformationStructural formula
Name Hydrangenoside C
Formula C29H38O12
Mw 578.23632668
CAS RN 74565-25-6
C_ID C00030496 ,
InChIKey GGNFGJZLCXTJLH-UMAFQGONNA-N
InChICode InChI=1S/C29H38O12/c1-3-20-21(12-19-11-17(32)10-18(39-19)9-6-15-4-7-16(31)8-5-15)22(27(36)37-2)14-38-28(20)41-29-26(35)25(34)24(33)23(13-30)40-29/h3-5,7-8,14,18-21,23-26,28-31,33-35H,1,6,9-13H2,2H3/t18-,19+,20-,21-,23+,24+,25-,26+,28+,29-/m0/s1
SMILES [C@H]1(O[C@H](CC(=O)C1)CCc1ccc(cc1)O)C[C@@H]1C(=CO[C@@H]([C@H]1C=C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHydrangeaceaeHydrangea macrophylla subsp.serrata (Thunb.) Makino Ref.
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OrganismHydrangea macrophylla subsp.serrata (Thunb.) Makino
ReferenceSakai,J.Nat.Med.,61,(2007),226