input word = C00029063

Metabolite InformationStructural formula
Name Styloguanidine
Formula C17H22ClN9O2
Mw 419.15849872
CAS RN 163089-72-3
C_ID C00029063 ,
InChIKey YQOJFYVIAPVKMS-PWFLQXOENA-N
InChICode InChI=1S/C17H22ClN9O2/c18-10-6(3-19)7-4-27-12(28)8-5(1-2-22-8)11-17(27,26-14(20)23-11)9(7)16(10)13(29)24-15(21)25-16/h1-2,6-7,9-11,13,22,29H,3-4,19H2,(H3,20,23,26)(H3,21,24,25)/t6-,7-,9+,10+,11+,13+,16+,17-/m1/s1
SMILES [C@@]123N(C(=O)c4c([C@@H]1N=C(N2)N)cc[nH]4)C[C@H]1[C@H]3[C@]2([C@H]([C@@H]1CN)Cl)[C@@H](N=C(N2)N)O
Start Substs in Alk. Biosynthesis (Prediction) L-Asp
Organism
Kingdom Family Species Reference
--Stylorella aurantium Ref.
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OrganismStylorella aurantium
ReferenceKato,Tetrahedron Lett.,36,(1995),2133