| Name |
Thiazomycin E1 |
| Formula |
C50H55N13O16S5 |
| Mw |
1253.24932646 |
| CAS RN |
905946-72-7 |
| C_ID |
C00048202
, 
|
| InChIKey |
MVHBCLZSBYPNKG-DXJNIWACNA-N |
| InChICode |
InChI=1S/C50H55N13O16S5/c1-17(38(51)68)52-39(69)24-14-83-47(57-24)33-28(66)9-21-32(59-33)23-12-81-45(54-23)22(11-64)53-40(70)25-15-84-48(58-25)34(35(67)36(49(74)75)79-29-10-50(5,76)37(63(6)7)20(4)78-29)62-42(72)27-16-82-46(56-27)31(19(3)77-8)61-43(73)30(18(2)65)60-41(71)26-13-80-44(21)55-26/h9,12-16,18,20,22,29-30,34-37,64-67,76H,1,10-11H2,2-8H3,(H2,51,68)(H,52,69)(H,53,70)(H,60,71)(H,61,73)(H,62,72)(H,74,75)/b31-19+/t18-,20-,22+,29+,30+,34-,35-,36+,37-,50-/m0/s1 |
| SMILES |
c12c(cc(c(n1)c1scc(n1)C(=O)NC(=C)C(=O)N)O)c1nc(cs1)C(=O)N[C@@H](C(=O)N/C(=C(\C)/OC)/c1nc(cs1)C(=O)N[C@H](c1scc(C(=O)N[C@@H](c3scc2n3)CO)n1)[C@H](O)[C@H](C(=O)O)O[C@H]1O[C@H]([C@@H]([C@](C1)(O)C)N(C)C)C)[C@H](C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Tyr |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Pseudonocardiaceae | Amycolatopsis fastidiosa | Ref. |
|
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