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 c12c(nc3c(n1)C[C@]1([C@H](C3)CC[C@@H]3[C@@H]1C[C@H]([C@]1([C@@H]3C[C@H]3[C@@H]1[C@@H]([C@]1(O3)OC(CC1)(C)C)C)C)O)C)C[C@]1([C@H](C2)CC[C@@H]2[C@@H]1CC(=O)[C@]12[C@@]([C@@H]2[C@H](C1)O[C@@]1([C@H]2C)OC(CC1)(C)C)(C)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp Cholesterol
Organism
Kingdom Family Species Reference
AnimaliaPolyclinidaeRitterella tokioka Ref.
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