Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024437
PROPERTIES
| NPAID | NPA024437 |
|---|---|
| CLUSTER ID | 7474 |
| NODE ID | 5112 |
| NAME | WS9326G |
| FORMULA | C50H63N7O12 |
| MOLECULAR WEIGHT (Da) | 954.0910 |
| ACCURATE MASS (Da) | 953.4535 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | asterosporus DSM 41452 |
| InChIKey | LNQYORFYYXHXPB-KNYYYOTRSA-N |
| InChI | InChI=1S/C50H63N7O12/c1-6-7-9-16-34-17-12-13-18-35(34)21-24-43(62)52-40(29-58)49(67)57(5)41(27-33-19-22-36(60)23-20-33)47(65)54-37(25-30(2)3)45(63)53-38(26-32-14-10-8-11-15-32)46(64)56-44(31(4)59)48(66)55-39(50(68)69)28-42(51)61/h8-24,27,30-31,37-40,44,58-60H,6-7,25-26,28-29H2,1-5H3,(H2,51,61)(H,52,62)(H,53,63)(H,54,65)(H,55,66)(H,56,64)(H,68,69)/b16-9-,24-21+,41-27+/t31?,37-,38+,39-,40-,44-/m0/s1 |
| SMILES | CCC/C=C\C1=CC=CC=C1/C=C/C(=O)N[C@@H](CO)C(=O)N(C)/C(=C/C2=CC=C(C=C2)O)/C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC3=CC=CC=C3)C(=O)N[C@@H](C(C)O)C(=O)N[C@@H](CC(=O)N)C(=O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Songya; Zhu, Jing; Zechel, David L.; Jessen-Trefzer, Claudia; Eastman, Richard T.; Paululat, Thomas; Bechthold, Andreas New WS9326A Derivatives and One New Annimycin Derivative with Antimalarial Activity are Produced by Streptomyces asterosporus DSM 41452 and Its Mutant ChemBioChem 2018 19 (3) 272-279. | ||
|---|---|---|---|
| DOI | 10.1002/cbic.201700428 | PMID | 29148157 |
