input word = C00050909

Metabolite InformationStructural formula
Name Isodoglutinosin A
Formula C22H30O6
Mw 390.20423869
CAS RN 192863-86-8
C_ID C00050909
InChIKey MFCOHVCBVHYCHP-VROGTIQNNA-N
InChICode InChI=1S/C22H30O6/c1-10-12-6-7-13-21(5)14(24)8-9-20(3,4)16(21)15(28-11(2)23)19(27)22(13,17(10)25)18(12)26/h12-16,18,24,26H,1,6-9H2,2-5H3/t12-,13-,14-,15-,16+,18?,21+,22-/m0/s1
SMILES C=C1C(=O)[C@@]23C(=O)[C@@H](OC(C)=O)[C@@H]4C(C)(C)CC[C@H](O)[C@@]4(C)[C@@H]2CC[C@@H]1C3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon glutinosa Ref.
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