Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA024684
PROPERTIES
| NPAID | NPA024684 |
|---|---|
| CLUSTER ID | 4635 |
| NODE ID | 141 |
| NAME | Grisemycin |
| FORMULA | C86H137N21O21S |
| MOLECULAR WEIGHT (Da) | 1833.2350 |
| ACCURATE MASS (Da) | 1832.0019 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | griseus IFO 13350 |
| InChIKey | OIQYGWMODDNMOB-PTYYYPKJSA-N |
| InChI | InChI=1S/C86H137N21O21S/c1-20-47(13)68(85(127)100-60-42-129-37-35-89-81(123)65(44(7)8)102-76(118)57(38-43(5)6)98-79(60)121)104-74(116)53(22-3)94-78(120)59(41-108)93-64(111)40-90-73(115)55(31-33-62(87)109)97-84(126)69(48(14)21-2)105-83(125)67(46(11)12)103-77(119)58(39-52-28-25-24-26-29-52)99-75(117)56(32-34-63(88)110)96-70(112)49(15)92-82(124)66(45(9)10)101-71(113)50(16)91-80(122)61-30-27-36-107(61)86(128)54(23-4)95-72(114)51(17)106(18)19/h22-26,28-29,35,37,43-51,55-61,65-69,108H,20-21,27,30-34,36,38-42H2,1-19H3,(H2,87,109)(H2,88,110)(H,89,123)(H,90,115)(H,91,122)(H,92,124)(H,93,111)(H,94,120)(H,95,114)(H,96,112)(H,97,126)(H,98,121)(H,99,117)(H,100,127)(H,101,113)(H,102,118)(H,103,119)(H,104,116)(H,105,125)/b37-35-,53-22+,54-23-/t47-,48-,49?,50?,51?,55?,56?,57?,58?,59?,60?,61?,65?,66?,67?,68?,69?/m1/s1 |
| SMILES | CC[C@@H](C)C(C(=O)NC(CCC(=O)N)C(=O)NCC(=O)NC(CO)C(=O)N/C(=C/C)/C(=O)NC([C@H](C)CC)C(=O)NC1CS/C=C\NC(=O)C(NC(=O)C(NC1=O)CC(C)C)C(C)C)NC(=O)C(C(C)C)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CCC(=O)N)NC(=O)C(C)NC(=O)C(C(C)C)NC(=O)C(C)NC(=O)C3CCCN3C(=O)/C(=C/C)/NC(=O)C(C)N(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Claesen J; Bibb MJ Biosynthesis and regulation of grisemycin, a new member of the linaridin family of ribosomally synthesized peptides produced by Streptomyces griseus IFO 13350. Journal of Bacteriology 2011 193 (10) 2510-2516. | ||
|---|---|---|---|
| DOI | 10.1128/JB.00171-11 | PMID | 21421760 |
