input word = C00034673

Metabolite InformationStructural formula
Name Sanjoinine A dialdehyde
Formula C31H42N4O6
Mw 566.3104351
CAS RN 444798-08-7
C_ID C00034673 ,
InChIKey SBYSFXXWWVXKDP-IRLTZKMVNA-N
InChICode InChI=1S/C31H42N4O6/c1-7-21(4)26(30(39)32-19-37)33-31(40)27(28(20(2)3)41-24-15-13-23(18-36)14-16-24)34-29(38)25(35(5)6)17-22-11-9-8-10-12-22/h8-16,18-21,25-28H,7,17H2,1-6H3,(H,33,40)(H,34,38)(H,32,37,39)/t21-,25+,26+,27+,28+/m1/s1
SMILES CCC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)N(C)C)[C@@H](Oc1ccc(C=O)cc1)C(C)C)C(=O)NC=O
Start Substs in Alk. Biosynthesis (Prediction) L-Phe
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeZizyphus jujube var. inermis Ref.
PlantaeRhamnaceaeZizyphus vulgaris var.spinosus Ref.
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