| Name |
Roseorubicin A |
| Formula |
C54H78N2O18 |
| Mw |
1042.5249637 |
| CAS RN |
70559-00-1 |
| C_ID |
C00018222
, 
|
| InChIKey |
IWFXKTHFKLCDQJ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C54H78N2O18/c1-11-54(64)20-19-30-43(49(63)45-44(47(30)61)48(62)42-29(46(45)60)13-12-14-34(42)58)53(54)74-40-22-32(56(9)10)50(27(5)68-40)72-39-21-31(55(7)8)51(26(4)67-39)73-41-23-35(59)52(28(6)69-41)71-38-18-16-36(25(3)66-38)70-37-17-15-33(57)24(2)65-37/h12-14,24-28,31-33,35-41,50-53,57-59,61,63-64H,11,15-23H2,1-10H3/t24-,25+,26-,27-,28+,31+,32-,33+,35+,36+,37+,38+,39+,40+,41-,50+,51+,52-,53-,54+/m1/s1 |
| SMILES |
[C@@]1(CCc2c([C@H]1O[C@H]1C[C@H]([C@H]([C@H](O1)C)O[C@H]1C[C@@H]([C@H]([C@H](O1)C)O[C@@H]1C[C@@H]([C@@H]([C@@H](O1)C)O[C@H]1CC[C@@H]([C@@H](O1)C)O[C@H]1CC[C@@H]([C@H](O1)C)O)O)N(C)C)N(C)C)c(c1c(c2O)C(=O)c2c(C1=O)cccc2O)O)(CC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Arg Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Actinomycetaceae | Actinomyces roseoviolaceus A 529 (IFO 13081) | Ref. |
|
|
zoom in
| Organism | Actinomyces roseoviolaceus A 529 (IFO 13081) |
|---|
| Reference | Matsuzawa,J. Antibiotics,32,(1979),420 |
|---|
|
