input word = C00028911

Metabolite InformationStructural formula
Name Ritterazine C
Formula C54H78N2O9
Mw 898.5707321
CAS RN 160604-68-2
C_ID C00028911 ,
InChIKey WYFPLVWQFAJCKF-UHFFFAOYNA-N
InChICode InChI=1S/C54H78N2O9/c1-26-45-40(62-52(26)14-12-46(3,4)64-52)19-32-30-11-10-28-16-35-37(23-48(28,6)31(30)20-41(59)50(32,45)8)56-36-17-29-18-39(58)44-33(49(29,7)24-38(36)55-35)21-42(60)51(9)34(44)22-43-54(51,61)27(2)53(63-43)15-13-47(5,25-57)65-53/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 n1c2c(nc3c1C[C@@H]1[C@](C3)([C@H]3[C@H]([C@H](C1)O)C1=C[C@H]4[C@@]([C@@]1([C@@H](C3)O)C)([C@@H]([C@@]1(O4)O[C@@](CC1)(C)CO)C)O)C)C[C@H]1[C@@](C2)([C@@H]2[C@H](CC1)[C@@H]1[C@]([C@H](C2)O)([C@@H]2[C@@H](C1)O[C@@]1([C@H]2C)CCC(O1)(C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
AnimaliaPolyclinidaeRitterella tokioka Ref.
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