input word = C00028926

Metabolite InformationStructural formula
Name Ritterazine R
Formula C54H80N2O6
Mw 852.6016383
CAS RN 184766-99-2
C_ID C00028926 ,
InChIKey MRVBXVUCPPAJNQ-HWUPBTLGNA-N
InChICode InChI=1S/C54H80N2O6/c1-27-45-41(59-53(27)17-15-47(3,4)61-53)21-35-31-13-11-29-19-37-39(25-49(29,7)33(31)23-43(57)51(35,45)9)55-38-20-30-12-14-32-34(50(30,8)26-40(38)56-37)24-44(58)52(10)36(32)22-42-46(52)28(2)54(60-42)18-16-48(5,6)62-54/h27-36,41-46,57-58H,11-26H2,1-10H3/t27-,28+,29-,30-,31+,32+,33-,34-,35+,36+,41-,42-,43-,44-,45-,46-,49-,50-,51+,52+,53+,54+/m0/s1
SMILES CC1[C@H]2[C@H](C[C@@H]3[C@@H]4CC[C@H]5Cc6nc7c(nc6C[C@]5(C)[C@H]4CC(O)[C@@]32C)C[C@@H]2CC[C@H]3[C@H]4C[C@@H]5O[C@@]6(CCC(C)(C)O6)[C@@H](C)[C@@H]5[C@@]4(C)C(O)C[C@@H]3[C@@]2(C)C7)O[C@@]12CCC(C)(C)O2
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
AnimaliaPolyclinidaeRitterella tokioka Ref.
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