input word = C00029680

Metabolite InformationStructural formula
Name Ammajin
Marmesinin
(-)-Marmesinin
Formula C20H24O9
Mw 408.14203237
CAS RN 495-30-7
C_ID C00029680 ,
InChIKey HXCGUCZXPFBNRD-HQVZANRQNA-N
InChICode InChI=1S/C20H24O9/c1-20(2,29-19-18(25)17(24)16(23)13(8-21)28-19)14-6-10-5-9-3-4-15(22)27-11(9)7-12(10)26-14/h3-5,7,13-14,16-19,21,23-25H,6,8H2,1-2H3/t13-,14+,16-,17+,18-,19+/m1/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)OC(C)(C)[C@@H]1Cc2c(O1)cc1c(c2)ccc(=O)o1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica furcijuga KITAGAWA Ref.
PlantaeApiaceaeAngelica pubescens Ref.
PlantaeApiaceaeGlehnia littoralis Ref.
PlantaeApiaceaeHeracleum candicans WALL. Ref.
PlantaeApiaceaeOstericum koreanum Ref.
PlantaeRutaceaeAegle marmelos Ref.
PlantaeRutaceaeRuta graveolens Ref.
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