input word =
C00026078
Metabolite Information
Structural formula
Name
Voacamidine
Formula
C43H52N4O5
Mw
704.3937708
CAS RN
6897-4-7
C_ID
C00026078 ,
InChIKey
ZOKLEFHBOMGEIR-JAHAZDFLNA-N
InChICode
InChI=1S/C43H52N4O5/c1-7-24-15-23-20-43(42(49)52-6)39-28(13-14-47(21-23)40(24)43)36-30(16-26(50-4)17-34(36)45-39)31-18-29-25(8-2)22-46(3)35(37(29)41(48)51-5)19-32-27-11-9-10-12-33(27)44-38(31)32/h8-12,16-17,23-24,29,31,35,37,40,44-45H,7,13-15,18-22H2,1-6H3/b25-8-/t23-,24+,29-,31-,35-,37+,40+,43+/m1/s1
SMILES
[C@H]12CN3[C@H]([C@@](c4[nH]c5cc(cc(c5c4CC3)[C@@H]3c4[nH]c5ccccc5c4C[C@H]4N(C/C(=C/C)/[C@@H](C3)[C@@H]4C(=O)OC)C)OC)(C1)C(=O)OC)[C@H](C2)CC
Start Substs in Alk. Biosynthesis (Prediction)
L-Trp
Secologanin
Organism
Kingdom
Family
Species
Reference
Plantae
Apocynaceae
Tabernaemontana accedens Mull.Arg.
Ref.
Plantae
Apocynaceae
Tabernaemontana echinata Vell.
Ref.
Plantae
Apocynaceae
Voacanga africana Stapf.
Ref.
Plantae
Apocynaceae
Voacanga papuana
Ref.
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