input word = C00027215

Metabolite InformationStructural formula
Name Hemsine D
Formula C29H38N4O4
Mw 506.28930573
CAS RN 530092-45-6
C_ID C00027215 ,
InChIKey XSBUQJKROKZPTL-HKQRACQWNA-N
InChICode InChI=1S/C29H38N4O4/c1-6-19(4)24-27(34)31-17-16-20-12-14-22(15-13-20)37-26(21-10-8-7-9-11-21)25(29(36)32-24)33-28(35)23(30-5)18(2)3/h7-19,23-26,30H,6H2,1-5H3,(H,31,34)(H,32,36)(H,33,35)/b17-16-/t19-,23-,24-,25-,26+/m0/s1
SMILES c1c2ccc(c1)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N/C=C/2)[C@@H](C)CC)NC(=O)[C@H](C(C)C)NC)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaePaliurus hemsleyanus Ref.
PlantaeRhamnaceaePaliurus racemosus Ref.
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