Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012123
PROPERTIES
| NPAID | NPA012123 |
|---|---|
| CLUSTER ID | 275 |
| NODE ID | 249 |
| NAME | A10255G |
| FORMULA | C52H46N16O15S3 |
| MOLECULAR WEIGHT (Da) | 1231.2380 |
| ACCURATE MASS (Da) | 1230.2491 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | gardneri (NRRL 15537) |
| InChIKey | YBOCJDKNYICWMG-UHFFFAOYSA-N |
| InChI | InChI=1S/C52H46N16O15S3/c1-10-28-49-55-13-32(83-49)44(76)54-16-35-53-14-33(85-35)45(77)62-24(7)50-56-15-34(86-50)46(78)60-22(5)40(72)61-23(6)48-66-30(17-82-48)37-27(51-67-31(18-84-51)43(75)68-36(26(9)69)47(79)65-28)11-12-29(64-37)42(74)59-21(4)39(71)57-19(2)38(70)58-20(3)41(73)63-25(8)52(80)81/h10-15,17-18,24,26,36,69H,2-6,8,16H2,1,7,9H3,(H,54,76)(H,57,71)(H,58,70)(H,59,74)(H,60,78)(H,61,72)(H,62,77)(H,63,73)(H,65,79)(H,68,75)(H,80,81) |
| SMILES | CC=C1C2=NC=C(O2)C(=O)NCC3=NC=C(S3)C(=O)NC(C4=NC=C(S4)C(=O)NC(=C)C(=O)NC(=C)C5=NC(=CO5)C6=C(C=CC(=N6)C(=O)NC(=C)C(=O)NC(=C)C(=O)NC(=C)C(=O)NC(=C)C(=O)O)C7=NC(=CS7)C(=O)NC(C(=O)N1)C(C)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Debono, Manuel; Molloy, R. Michael; Occolowitz, John L.; Paschal, Jonathan W.; Hunt, Ann H.; et al. The Structures of A10255B, -G, and -J: New Thiopeptide Antibiotics Produced by Streptomyces gardneri Journal of Organic Chemistry 1992 57 (19) 5200-5208. | ||
|---|---|---|---|
| DOI | 10.1021/jo00045a037 | PMID | - |
