| Name |
Antibiotic 42D005beta
Pyrroindomycin B |
| Formula |
C60H79ClN4O15 |
| Mw |
1130.52304559 |
| CAS RN |
160472-95-7 |
| C_ID |
C00016693
, 
|
| InChIKey |
WQAIHFLTXXLZSQ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C60H79ClN4O15/c1-9-31-24-57(6)25-37(55(70)71)27(2)23-60(57)51(68)48(54(69)65-60)50(67)59(8)32(19-41(31)66)13-15-34-38(59)11-10-12-43(34)78-45-18-17-42(28(3)74-45)77-47-26-58(7,73)52(30(5)76-47)80-46-22-44(49(62)29(4)75-46)79-56(72)40-21-36-35-20-33(61)14-16-39(35)63-53(36)64-40/h13-16,20-21,25,27-32,34,38,41-47,49,52,63-64,66,68,73H,9-12,17-19,22-24,26,62H2,1-8H3,(H,65,69)(H,70,71)/t27-,28-,29+,30-,31-,32+,34-,38-,41+,42-,43-,44+,45-,46-,47-,49-,52+,57-,58+,59-,60+/m1/s1 |
| SMILES |
[C@@]123[C@](C[C@H]([C@H](C[C@H]4[C@@](C(=O)C(=C3O)C(=O)N1)([C@H]1[C@@H](C=C4)[C@@H](CCC1)O[C@@H]1CC[C@H]([C@H](O1)C)O[C@@H]1C[C@@]([C@H]([C@H](O1)C)O[C@@H]1C[C@@H]([C@@H]([C@@H](O1)C)N)OC(=O)c1[nH]c3c(c1)c1c([nH]3)ccc(c1)Cl)(O)C)C)O)CC)(C=C([C@@H](C2)C)C(=O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Trp L-Pro Secologanin |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Bacteria | Streptomycetaceae | Streptomyces rugosporus sp. LL-42D005 | Ref. |
|
|
zoom in
| Organism | Streptomyces rugosporus sp. LL-42D005 |
|---|
| Reference | Ding,J. Antibiotics,47,(1994),1250 |
|---|
|
