input word = C00027402

Metabolite InformationStructural formula
Name Korundamine A
Formula C47H48N2O8
Mw 768.34106652
CAS RN 212957-33-0
C_ID C00027402 ,
InChIKey NYSXYPCUWVSERK-UHFFFAOYNA-N
InChICode InChI=1S/C47H48N2O8/c1-20-10-27-29(41-33-15-23(4)49-25(6)40(33)35(51)19-36(41)52)17-31(45(53)43(27)37(12-20)55-7)32-18-30(28-11-21(2)13-38(56-8)44(28)46(32)54)42-34(50)16-26-14-22(3)48-24(5)39(26)47(42)57-9/h10-13,16-19,22-23,25,49-54H,14-15H2,1-9H3/t22-,23+,25-/m1/s1
SMILES c12c(cc(c(c1OC)c1c3c(c(c(c1)c1cc(c4c(c1O)c(cc(c4)C)OC)c1c4c(c(cc1O)O)[C@H](N[C@H](C4)C)C)O)c(cc(c3)C)OC)O)C[C@H](N=C2C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeAncistrocladaceaeAncistrocladus korupensis Ref.
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