input word = C00012055

Metabolite InformationStructural formula
Name (+)-Elemacarmanin
Elemacarmanin
Formula C20H28O7
Mw 380.18350325
CAS RN 105242-48-6
C_ID C00012055 ,
InChIKey HHUHNVIGEYMOJY-XJHFZRBNNA-N
InChICode InChI=1S/C20H28O7/c1-7-20(5)8-14(27-18(24)12(3)10-22)15(13(4)19(25)26-6)17(23)16(20)11(2)9-21/h7,14-17,21-23H,1-4,8-10H2,5-6H3/t14-,15+,16+,17-,20+/m0/s1
SMILES C=C[C@]1(C)CC(OC(=O)C(=C)CO)[C@@H](C(=C)C(=O)OC)C(O)[C@H]1C(=C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeOnopordon carmanicum Ref.
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