input word = C00028924

Metabolite InformationStructural formula
Name Ritterazine P
Formula C54H78N2O7
Mw 866.58090286
CAS RN 184765-85-3
C_ID C00028924 ,
InChIKey RPXMJJDFMQEOKE-MPCXSIMZNA-N
InChICode InChI=1S/C54H78N2O7/c1-27-44-40(60-53(27)17-15-46(3,4)62-53)21-34-31-13-11-29-19-36-38(24-48(29,7)33(31)22-42(57)50(34,44)9)55-37-20-30-12-14-32-35(49(30,8)25-39(37)56-36)23-43(58)52(32)26-41-45(51(52,10)59)28(2)54(61-41)18-16-47(5,6)63-54/h27-35,40-42,44-45,57,59H,11-26H2,1-10H3/t27-,28-,29-,30-,31+,32+,33-,34+,35-,40-,41-,42+,44-,45-,48-,49-,50+,51-,52-,53+,54+/m0/s1
SMILES C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@H]4CC[C@H]5Cc6nc7c(nc6C[C@]5(C)[C@H]4C[C@@H](O)[C@]23C)C[C@@H]2CC[C@@H]3[C@H](CC(=O)[C@]34C[C@@H]3O[C@@]5(CCC(C)(C)O5)[C@@H](C)[C@@H]3[C@]4(C)O)[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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OrganismRitterella tokioka
ReferenceFukuzawa,J.Org.Chem.,62,(1997),4484