input word = C00003424

Metabolite InformationStructural formula
Name Enmein
Formula C20H26O6
Mw 362.17293856
CAS RN 3776-39-4
C_ID C00003424 ,
InChIKey MQOJPNKACWKUGI-VMJIGMBCNA-N
InChICode InChI=1S/C20H26O6/c1-9-10-4-5-11-19(7-10,15(9)22)17(24)26-13-6-12(21)18(2,3)14-16(23)25-8-20(11,13)14/h10-14,16,21,23H,1,4-8H2,2-3H3/t10-,11-,12+,13+,14-,16-,19+,20-/m1/s1
SMILES C=C1C(=O)[C@]23C[C@H]1CC[C@H]2[C@@]12CO[C@@H](O)[C@@H]1C(C)(C)[C@@H](O)C[C@@H]2OC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon japonica Ref.
PlantaeLabiataeIsodon japonicus Hara. Ref.
PlantaeLabiataeIsodon oresbius Ref.
PlantaeLabiataeIsodon sculponeatus Ref.
PlantaeLabiataeIsodon trichocarpus Ref.
PlantaeLabiataePlectranthus trichocarpus Ref.
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OrganismPlectranthus trichocarpus
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter52