input word = C00028958

Metabolite InformationStructural formula
Name Sanjoinine D
O-Methylsanjoinine G1
Formula C32H46N4O5
Mw 566.34682061
CAS RN 107462-34-0
C_ID C00028958 ,
InChIKey FYTPTQFRMLVCGF-UHFFFAOYNA-N
InChICode InChI=1S/C32H46N4O5/c1-8-21(4)27-31(38)33-19-26(40-7)23-14-16-24(17-15-23)41-29(20(2)3)28(32(39)34-27)35-30(37)25(36(5)6)18-22-12-10-9-11-13-22/h9-17,20-21,25-29H,8,18-19H2,1-7H3,(H,33,38)(H,34,39)(H,35,37)/t21-,25-,26+,27+,28+,29-/m1/s1
SMILES CCC(C)C1NC(=O)C(NC(=O)C(Cc2ccccc2)N(C)C)C(C(C)C)Oc2ccc(cc2)C(OC)CNC1=O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeZiziphus jujuba var.spinosa Ref.
PlantaeRhamnaceaeZizyphus jujube var. inermis Ref.
PlantaeRhamnaceaeZizyphus vulgaris var. spinosus Ref.
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OrganismZiziphus jujuba var.spinosa
ReferenceChinese Materia Medica Editing Committee of the National Chinese Medicine and Pharmacology Bureau, Chinese Materia Medica (ZHONG HUA BEN CAO), Vol.1-Vol.30, Shanghai Science and technology Press, Shanghai, (1999)