Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018015
PROPERTIES
| NPAID | NPA018015 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 26 |
| NAME | Streptocidin A |
| FORMULA | C65H90N14O13 |
| MOLECULAR WEIGHT (Da) | 1275.5200 |
| ACCURATE MASS (Da) | 1274.6812 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | CFLSWSZLIXSQDV-ORZFRKGWSA-N |
| InChI | InChI=1S/C65H90N14O13/c1-35(2)28-46-59(86)77-51(31-38-14-8-7-9-15-38)65(92)79-27-13-19-52(79)63(90)76-47(29-36(3)4)58(85)74-49(32-40-34-69-43-17-11-10-16-42(40)43)60(87)75-50(33-54(68)82)61(88)70-45(24-25-53(67)81)57(84)73-48(30-39-20-22-41(80)23-21-39)62(89)78-55(37(5)6)64(91)71-44(18-12-26-66)56(83)72-46/h7-11,14-17,20-23,34-37,44-52,55,69,80H,12-13,18-19,24-33,66H2,1-6H3,(H2,67,81)(H2,68,82)(H,70,88)(H,71,91)(H,72,83)(H,73,84)(H,74,85)(H,75,87)(H,76,90)(H,77,86)(H,78,89)/t44-,45-,46-,47-,48-,49+,50-,51+,52-,55-/m0/s1 |
| SMILES | CC(C)C[C@H]1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N1)CC3=CC=CC=C3)CC(C)C)CCCN)C(C)C)CC4=CC=C(C=C4)O)CCC(=O)N)CC(=O)N)CC5=CNC6=CC=CC=C65 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Höltzel, A; Jack, R W; Nicholson, G J; Jung, G; Gebhardt, K; Fiedler, H P; Süssmuth, R D Streptocidins A-D, novel cyclic decapeptide antibiotics produced by Streptomyces sp. Tü 6071. II. Structure elucidation Journal of Antibiotics 2001 54 (5) 434-440. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.54.434 | PMID | 11480887 |
