input word = C00029323

Metabolite InformationStructural formula
Name Deoxypumiloside
(3R)-Deoxypumiloside
3(R)-Deoxypumiloside
Formula C26H28N2O8
Mw 496.18456589
CAS RN 185020-37-5
C_ID C00029323 ,
InChIKey BNDDTTIRGZIQSE-SHHSZVDDNA-N
InChICode InChI=1S/C26H28N2O8/c1-2-14-15-8-18-20-13(7-12-5-3-4-6-17(12)27-20)9-28(18)24(33)16(15)11-34-25(14)36-26-23(32)22(31)21(30)19(10-29)35-26/h2-7,11,14-15,18-19,21-23,25-26,29-32H,1,8-10H2/t14-,15-,18+,19+,21+,22-,23+,25-,26-/m0/s1
SMILES C=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3Cc4cc5ccccc5nc4[C@H]3C[C@H]21
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeGelsemiaceaeMostuea brunnonis Ref.
PlantaeGelsemiaceaeMostuea brunonis Didr. Ref.
PlantaeRubiaceaeOphiorrhiza liukiuensis Ref.
PlantaeRubiaceaeOphiorrhiza pumila Ref.
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