Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA030776
PROPERTIES
| NPAID | NPA030776 |
|---|---|
| CLUSTER ID | 8985 |
| NODE ID | 96 |
| NAME | Talaropeptide B |
| FORMULA | C70H120N12O14 |
| MOLECULAR WEIGHT (Da) | 1353.8000 |
| ACCURATE MASS (Da) | 1352.9047 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Talaromyces |
| ORIGIN SPECIES | sp. |
| InChIKey | CWUNJRMISPNJFK-DTNNBZDOSA-N |
| InChI | InChI=1S/C70H120N12O14/c1-26-44(16)58(62(87)72-48(70(95)96)35-37(2)3)81(25)65(90)50(36-47-31-28-27-29-32-47)76(20)67(92)55(41(10)11)80(24)68(93)56(42(12)13)78(22)64(89)49-33-30-34-82(49)69(94)57(43(14)15)79(23)66(91)52(39(6)7)74-60(85)53(46(18)83)75-59(84)51(38(4)5)73-61(86)54(40(8)9)77(21)63(88)45(17)71-19/h27-29,31-32,37-46,48-58,71,83H,26,30,33-36H2,1-25H3,(H,72,87)(H,73,86)(H,74,85)(H,75,84)(H,95,96)/t44-,45-,46+,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-/m0/s1 |
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)N(C)C(=O)[C@H](CC1=CC=CC=C1)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)NC)C(C)C)[C@@H](C)O)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Dewapriya, P; Khalil, ZG; Prasad, P; Salim, AA; Cruz-Morales, P; Marcellin, E; Capon, RJ Talaropeptides A-D: Structure and Biosynthesis of Extensively N-methylated Linear Peptides From an Australian Marine Tunicate-Derived Talaromyces sp. Frontiers in Chemistry 2018 6 394. | ||
|---|---|---|---|
| DOI | 10.3389/fchem.2018.00394 | PMID | 30234104 |
