input word = C00041731

Metabolite InformationStructural formula
Name Parvifoline J
(-)-Parvifoline J
Formula C23H34O8
Mw 438.22536806
CAS RN 882673-21-4
C_ID C00041731 ,
InChIKey HSPWQVFLXJMEHX-LYQKAVNUNA-N
InChICode InChI=1S/C23H34O8/c1-11(24)31-14-7-12-8-22(18(26)13(12)9-29-4)16(14)21-10-30-23(22,28)19(27)17(21)20(2,3)6-5-15(21)25/h12-17,19,25,27-28H,5-10H2,1-4H3/t12-,13-,14+,15+,16-,17-,19+,21-,22?,23-/m1/s1
SMILES [C@H]1([C@@]23[C@@H](C(CC1)(C)C)[C@@H]([C@]([C@@]14[C@@H]2[C@H](C[C@@H]([C@H](C1=O)COC)C4)OC(=O)C)(OC3)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon parvifolius Ref.
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OrganismIsodon parvifolius
ReferenceLi,J.Nat.Prod.,69,(2006),645