input word = C00028912

Metabolite InformationStructural formula
Name Ritterazine D
Formula C54H76N2O10
Mw 912.54999666
CAS RN 165172-44-1
C_ID C00028912 ,
InChIKey FHCSEAYKGLTPDJ-UHFFFAOYNA-N
InChICode InChI=1S/C54H76N2O10/c1-26-44-39(64-52(26)14-12-45(3,4)66-52)24-51(50(44,9)61)30-11-10-28-16-34-36(22-47(28,6)31(30)19-41(51)59)56-35-17-29-18-38(57)43-32(48(29,7)23-37(35)55-34)20-40(58)49(8)33(43)21-42-54(49,62)27(2)53(65-42)15-13-46(5,60)25-63-53/h21,26-32,38-40,42-44,57-58,60-62H,10-20,22-25H2,1-9H3/t26-,27-,28+,29-,30-,31-,32-,38+,39-,40-,42-,43-,44+,46+,47+,48-,49+,50+,51+,52-,53-,54+/m1/s1
SMILES n1c2c(nc3c1C[C@H]1[C@](C3)([C@H]3[C@@H](CC1)[C@@]1(C[C@@H]4[C@@H]([C@@]1(O)C)[C@H]([C@@]1(O4)CCC(O1)(C)C)C)C(=O)C3)C)C[C@H]1[C@@](C2)([C@H]2[C@@H]([C@H](C1)O)C1=C[C@@H]3[C@]([C@@]1([C@@H](C2)O)C)([C@@H]([C@]1(O3)CC[C@](CO1)(C)O)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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