input word = C00057999

Metabolite InformationStructural formula
Name 11,12,14-Trihydroxy-7-methoxy-8,11,13-abietatrien-20,6-olide
Formula C21H28O6
Mw 376.18858863
CAS RN 197649-67-5
C_ID C00057999
InChIKey LBJNLIBZUVWVTE-NYUBLWNDSA-N
InChICode InChI=1S/C21H28O6/c1-9(2)10-13(22)11-12(15(24)14(10)23)21-8-6-7-20(3,4)18(21)17(16(11)26-5)27-19(21)25/h9,16-18,22-24H,6-8H2,1-5H3/t16-,17+,18-,21-/m0/s1
SMILES CO[C@H]1c2c(O)c(C(C)C)c(O)c(O)c2[C@@]23CCCC(C)(C)[C@@H]2[C@@H]1OC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeRosmarinus officinalis Ref.
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