input word = C00046180

Metabolite InformationStructural formula
Name Myrianthine A
Formula C31H42N4O4
Mw 534.32060586
CAS RN 24532-76-1
C_ID C00046180 ,
InChIKey LPDQFEUVGGZEQL-FMQUCBEENA-N
InChICode InChI=1S/C31H42N4O4/c1-6-8-14-25(35(4)5)29(36)34-27-28(23-12-10-9-11-13-23)39-24-17-15-22(16-18-24)19-20-32-30(37)26(21(3)7-2)33-31(27)38/h9-13,15-21,25-28H,6-8,14H2,1-5H3,(H,32,37)(H,33,38)(H,34,36)/b20-19+/t21-,25+,26+,27+,28+/m0/s1
SMILES c1cc2/C=C/NC(=O)[C@H](NC(=O)[C@@H]([C@H](Oc1cc2)c1ccccc1)NC(=O)[C@H](N(C)C)CCCC)[C@@H](C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeDiscaria americana Ref.
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