| Name |
Rhodirubin A |
| Formula |
C42H55NO16 |
| Mw |
829.35208472 |
| CAS RN |
64253-73-2 |
| C_ID |
C00018140
, 
|
| InChIKey |
WGXOAYYFWFRVSV-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C42H55NO16/c1-8-42(52)16-27(31-20(35(42)41(51)53-7)13-21-32(37(31)49)38(50)34-25(46)10-9-24(45)33(34)36(21)48)57-29-14-22(43(5)6)39(18(3)55-29)59-30-15-26(47)40(19(4)56-30)58-28-12-11-23(44)17(2)54-28/h9-10,13,17-19,22-23,26-30,35,39-40,44-47,49,52H,8,11-12,14-16H2,1-7H3/t17-,18-,19+,22-,23+,26+,27+,28+,29+,30-,35+,39-,40-,42-/m1/s1 |
| SMILES |
C1[C@@]([C@@H](c2c([C@H]1O[C@@H]1O[C@@H]([C@H]([C@@H](C1)N(C)C)O[C@H]1O[C@H]([C@@H](O[C@@H]3O[C@@H]([C@H](CC3)O)C)[C@H](C1)O)C)C)c(c1c(c2)C(=O)c2c(C1=O)c(ccc2O)O)O)C(=O)OC)(CC)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr L-Lys Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Streptomycetaceae | Streptomyces sp. ME505-HE1 | Ref. |
|
|
zoom in
| Organism | Streptomyces sp. ME505-HE1 |
|---|
| Reference | Kitamura,J. Antibiotics,30,(1977),616 |
|---|
|
