input word = C00034675

Metabolite InformationStructural formula
Name Sanjoinine B
Formula C30H40N4O4
Mw 520.30495579
CAS RN 107462-33-9
C_ID C00034675 ,
InChIKey VABCJXJBSCOYDW-WUKNDPDINA-N
InChICode InChI=1S/C30H40N4O4/c1-6-20(4)25-29(36)32-17-16-21-12-14-23(15-13-21)38-27(19(2)3)26(30(37)33-25)34-28(35)24(31-5)18-22-10-8-7-9-11-22/h7-17,19-20,24-27,31H,6,18H2,1-5H3,(H,32,36)(H,33,37)(H,34,35)/b17-16+/t20-,24-,25-,26+,27-/m1/s1
SMILES CCC(C)C1NC(=O)C(NC(=O)C(Cc2ccccc2)NC)C(C(C)C)Oc2ccc(cc2)/C=C/NC1=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)