input word = C00028910

Metabolite InformationStructural formula
Name Ritterazine B
Formula C54H78N2O9
Mw 898.5707321
CAS RN 160568-10-5
C_ID C00028910 ,
InChIKey ORQGJGXNWBQQPK-ZJIUORISNA-N
InChICode InChI=1S/C54H78N2O9/c1-26-45-40(63-52(26)14-12-46(3,4)65-52)19-32-30-11-10-28-16-35-37(23-48(28,6)31(30)20-41(58)50(32,45)8)56-36-17-29-18-39(57)44-33(49(29,7)24-38(36)55-35)21-42(59)51(9)34(44)22-43-54(51,61)27(2)53(64-43)15-13-47(5,60)25-62-53/h22,26-33,39-45,57-61H,10-21,23-25H2,1-9H3/t26-,27+,28-,29+,30+,31-,32+,33-,39-,40-,41+,42+,43-,44+,45-,47-,48-,49-,50+,51+,52-,53+,54+/m0/s1
SMILES CC1[C@@]2(CC[C@](C)(O)CO2)O[C@H]2C=C3[C@@H]4[C@@H](O)C[C@H]5Cc6nc7c(nc6C[C@]5(C)[C@H]4CC(O)[C@]3(C)[C@@]12O)C[C@@H]1CC[C@H]2[C@H]3C[C@@H]4O[C@]5(CCC(C)(C)O5)[C@@H](C)[C@@H]4[C@@]3(C)[C@H](O)C[C@@H]2[C@@]1(C)C7
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
AnimaliaPolyclinidaeRitterella tokioka Ref.
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OrganismRitterella tokioka
ReferenceFukuzawa,J.Org.Chem.,59,(1994),6164

Fukuzawa,J.Org.Chem.,60,(1995),608

Fukuzawa,Tetrahedron,51,(1995),6707