input word = C00005572

Metabolite InformationStructural formula
Name Isorhamnetin 3-(2G-galactosylrutinoside)
Isorhamnetin 3-galactosyl-(1->2)-[rhamnosyl-(1->6)-glucoside]
Quercetin 3'-methyl ether 3-galactosyl-(1->2)-[rhamnosyl-(1->6)-glucoside]
Calotropiside
3-[(O-6-Deoxy-alpha-L-mannopyranosyl-(1->6)-O-[beta-D-galactopyranosyl-(1->2)]-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one
Formula C34H42O21
Mw 786.22185841
CAS RN 144606-94-0
C_ID C00005572 ,
InChIKey IPNYNJAPZARORI-NCQNVFDHNA-N
InChICode InChI=1S/C34H42O21/c1-10-20(39)24(43)27(46)32(50-10)49-9-18-22(41)26(45)31(55-33-28(47)25(44)21(40)17(8-35)52-33)34(53-18)54-30-23(42)19-14(38)6-12(36)7-16(19)51-29(30)11-3-4-13(37)15(5-11)48-2/h3-7,10,17-18,20-22,24-28,31-41,43-47H,8-9H2,1-2H3/t10-,17+,18+,20+,21-,22+,24+,25-,26+,27-,28-,31+,32-,33+,34+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O)O)O)O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)c1ccc(c(c1)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeCalotropis gigantea Ref.
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