input word = C00041822

Metabolite InformationStructural formula
Name Salvidivin C
(-)-Salvidivin C
Formula C23H28O10
Mw 464.16824712
CAS RN 917951-69-0
C_ID C00041822 ,
InChIKey JLLALLSXASKWMT-YDJLMQMPNA-N
InChICode InChI=1S/C23H28O10/c1-11(24)32-15-10-14(21(30)31-4)23(3)8-6-13(19(27)28)22(2,18(23)17(15)26)7-5-12-9-16(25)33-20(12)29/h5,7,9,13-15,18,20,29H,6,8,10H2,1-4H3,(H,27,28)/b7-5+/t13-,14-,15-,18+,20+,22+,23-/m0/s1
SMILES C(=C\C1=CC(=O)O[C@H]1O)/[C@@]1([C@H](C(=O)O)CC[C@@]2([C@@H]1C(=O)[C@H](C[C@H]2C(=O)OC)OC(=O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia divinorum Ref.
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OrganismSalvia divinorum
ReferenceShirota,J.Nat.Prod.,69,(2006),1782