input word = C00031124

Metabolite InformationStructural formula
Name RA II
Formula C40H48N6O9
Mw 756.34827718
CAS RN 106235-26-1
C_ID C00031124 ,
InChIKey KXVWPJGBRWNKFP-KFBFFQNENA-N
InChICode InChI=1S/C40H48N6O9/c1-22-35(48)42-23(2)38(51)44(4)30(18-25-8-13-28(47)14-9-25)37(50)43-24(3)39(52)46(6)32-19-26-10-15-29(16-11-26)55-34-21-27(12-17-33(34)54-7)20-31(36(49)41-22)45(5)40(32)53/h8-17,21-24,30-32,47H,18-20H2,1-7H3,(H,41,49)(H,42,48)(H,43,50)/t22-,23+,24+,30+,31+,32+/m1/s1
SMILES N1[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H]2Cc3ccc(cc3)Oc3c(ccc(C[C@@H](C(=O)N[C@@H](C1=O)C)N(C2=O)C)c3)OC)C)C)Cc1ccc(cc1)O)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeRubia akane Ref.
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