input word =
C00025064
Metabolite Information
Structural formula
Name
(+)-Kopsoffinol
Kopsoffinol
Formula
C40H48N4O3
Mw
632.37264143
CAS RN
96935-25-0
C_ID
C00025064 ,
InChIKey
NKQJSTGACVZXMS-YMXWPPEKNA-N
InChICode
InChI=1S/C40H48N4O3/c1-24(45)38-13-6-17-42-19-11-27-26-7-3-4-8-31(26)44(33(27)34(38)42)32(23-38)25-9-10-30-28(21-25)39-16-20-43-18-5-12-37(36(39)43)14-15-40(39,41-30)29(22-37)35(46)47-2/h3-4,7-10,21,24,29,32,34,36,41,45H,5-6,11-20,22-23H2,1-2H3/t24-,29+,32-,34-,36+,37-,38+,39-,40-/m1/s1
SMILES
C1CC[C@@]2([C@@H]3N1CCc1c3n([C@H](C2)c2ccc3c(c2)[C@]24[C@@]5(N3)CC[C@@]3([C@@H]4N(CCC3)CC2)C[C@H]5C(=O)OC)c2c1cccc2)[C@@H](C)O
Start Substs in Alk. Biosynthesis (Prediction)
L-Trp
L-Pro
Secologanin
IPP
Organism
Kingdom
Family
Species
Reference
Plantae
Apocynaceae
Kopsia dasyrachis
Ref.
Plantae
Apocynaceae
Kopsia pauciflora
Ref.
zoom in
