input word = C00006248

Metabolite InformationStructural formula
Name Isomolludistin 2''-O-glucoside
Formula C27H30O14
Mw 578.16355567
CAS RN 70521-83-4
C_ID C00006248 ,
InChIKey BEHBWZADGLBSSB-OEJYHDBVNA-N
InChICode InChI=1S/C27H30O14/c1-37-15-7-16-18(12(30)6-14(39-16)10-2-4-11(29)5-3-10)22(34)19(15)25-26(20(32)13(31)9-38-25)41-27-24(36)23(35)21(33)17(8-28)40-27/h2-7,13,17,20-21,23-29,31-36H,8-9H2,1H3/t13-,17-,20-,21-,23+,24-,25-,26-,27+/m1/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)[C@@H]1[C@@H]([C@@H]([C@@H](CO1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraceaeAsterostigma riedelianum Ref.
PlantaeRutaceaeAlmeidea guyanensis Ref.
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