input word = C00028933

Metabolite InformationStructural formula
Name Ritterazine Y
Formula C54H78N2O7
Mw 866.58090286
CAS RN 184770-06-7
C_ID C00028933 ,
InChIKey OQFYYRHPDXZIHN-XNRMWINANA-N
InChICode InChI=1S/C54H78N2O7/c1-27-45-41(61-53(27)17-15-48(5,59)26-60-53)20-35-31-12-10-29-18-37-39(24-49(29,6)33(31)22-43(57)51(35,45)8)55-38-19-30-11-13-32-34(50(30,7)25-40(38)56-37)23-44(58)52(9)36(32)21-42-46(52)28(2)54(62-42)16-14-47(3,4)63-54/h20,27-34,36,41-46,57-59H,10-19,21-26H2,1-9H3/t27-,28-,29-,30-,31+,32+,33-,34-,36+,41+,42-,43+,44-,45-,46-,48-,49-,50-,51+,52+,53+,54+/m0/s1
SMILES CC1[C@H]2[C@H](C=C3[C@@H]4CC[C@H]5Cc6nc7c(nc6C[C@]5(C)[C@H]4C[C@@H](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@]12CC[C@](C)(O)CO2
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
AnimaliaPolyclinidaeRitterella tokioka Ref.
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