input word = C00001019

Metabolite InformationStructural formula
Name Apiin
7-(2-Apiosylglucosyl)apigenin
Formula C26H28O14
Mw 564.14790561
CAS RN 26544-34-3
C_ID C00001019 ,
InChIKey NTDLXWMIWOECHG-IKPODFJPNA-N
InChICode InChI=1S/C26H28O14/c27-8-18-20(32)21(33)22(40-25-23(34)26(35,9-28)10-36-25)24(39-18)37-13-5-14(30)19-15(31)7-16(38-17(19)6-13)11-1-3-12(29)4-2-11/h1-7,18,20-25,27-30,32-35H,8-10H2/t18-,20+,21-,22+,23+,24+,25-,26+/m0/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O[C@H]1[C@H]([C@](O)(CO1)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeApium graveolens Ref.
PlantaeApiaceaePetroselinum crispum Ref.
PlantaeAsteraceaeAnthemis nobilis Ref.
PlantaeFabaceaeCrotalaria micans Ref.
PlantaeFabaceaeVicia balansae Ref.
PlantaeFabaceaeVicia hirsuta Ref.
PlantaeLythraceaeLawsonia alba Ref.
--Roman chamomile Ref.
zoom in