input word = C00026976

Metabolite InformationStructural formula
Name Waltherine C
Formula C30H37N5O4
Mw 531.28455471
CAS RN 256445-94-0
C_ID C00026976 ,
InChIKey LARYXOSDFXFMIS-CCEZHUSRNA-N
InChICode InChI=1S/C30H37N5O4/c1-18(2)27-26(30(38)33-19(3)28(36)31-15-14-20-10-12-22(39-27)13-11-20)34-29(37)25(35(4)5)16-21-17-32-24-9-7-6-8-23(21)24/h6-15,17-19,25-27,32H,16H2,1-5H3,(H,31,36)(H,33,38)(H,34,37)/b15-14+/t19-,25-,26-,27+/m0/s1
SMILES c1cc2/C=C/NC(=O)[C@@H](NC(=O)[C@H]([C@H](Oc1cc2)C(C)C)NC(=O)[C@H](Cc1c2c([nH]c1)cccc2)N(C)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeWaltheria douradinha Ref.
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