input word = C00014014

Metabolite InformationStructural formula
Name Cucumerin B
Formula C29H28O11
Mw 552.16316174
CAS RN 613254-11-8
C_ID C00014014 ,
InChIKey AEQPLRPDNSGKQU-CUDJVUAXNA-N
InChICode InChI=1S/C29H28O11/c1-12(13-2-6-15(31)7-3-13)20-24(35)22(29-27(38)26(37)23(34)19(11-30)40-29)25(36)21-17(33)10-18(39-28(20)21)14-4-8-16(32)9-5-14/h2-10,12,19,23,26-27,29-32,34-38H,11H2,1H3/t12-,19-,23+,26+,27-,29+/m1/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1)c(c(c(c2[C@H](C)c1ccc(cc1)O)O)[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeCucumis sativus Ref.
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OrganismCucumis sativus
ReferenceMac Nally,J.Nat.Prod.,66,(2003),1280