input word = C00026850

Metabolite InformationStructural formula
Name Thorectandramine
Formula C27H24N3O3
Mw 438.18176665
CAS RN 459165-95-8
C_ID C00026850 ,
InChIKey UGMSHHBPWHIIGZ-UHFFFAOYNA-O
InChICode InChI=1S/C27H23N3O3/c1-28-15-24(32)16-10-11-23(31)20(14-16)27(33)19-7-3-5-9-22(19)30-13-12-18-17-6-2-4-8-21(17)29-25(18)26(27)30/h2-14,24,28,31-33H,15H2,1H3/p+1/t24-,27+/m1/s1
SMILES c1ccc2c(c1)[nH]c1c2cc[n+]2c1[C@](c1c2cccc1)(c1cc(ccc1O)[C@H](O)CNC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
--Thoerectandra sp .(Kelly) Ref.
--Thorectandra sp. Ref.
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OrganismThorectandra sp.
ReferenceCharan,Tetrahedron Lett.,43,(2002),5201