Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033287
PROPERTIES
| NPAID | NPA033287 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Auyuittuqamide D |
| FORMULA | C52H86N10O12 |
| MOLECULAR WEIGHT (Da) | 1043.3180 |
| ACCURATE MASS (Da) | 1042.6427 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Sesquicillium |
| ORIGIN SPECIES | microsporum RKAG 186 |
| InChIKey | IPCZOWDKWCZGNZ-PZFLSJCKSA-N |
| InChI | InChI=1S/C52H86N10O12/c1-15-30(8)40-47(69)56-36(27-63)45(67)58-42(32(10)17-3)52(74)61(13)43(29(6)7)48(70)54-25-38(65)55-35(23-28(4)5)50(72)62(14)44(33(11)64)49(71)59-41(31(9)16-2)51(73)60(12)37(24-34-21-19-18-20-22-34)46(68)53-26-39(66)57-40/h18-22,28-33,35-37,40-44,63-64H,15-17,23-27H2,1-14H3,(H,53,68)(H,54,70)(H,55,65)(H,56,69)(H,57,66)(H,58,67)(H,59,71)/t30?,31?,32?,33?,35-,36-,37-,40-,41-,42-,43-,44-/m0/s1 |
| SMILES | CCC(C)[C@@H]1NC(=O)CNC(=O)[C@H](CC2=CC=CC=C2)N(C)C(=O)[C@H](C(C)CC)NC(=O)[C@H](C(C)O)N(C)C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)CC)NC(=O)[C@H](CO)NC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Grunwald, Alyssa L.; Cartmell, Christopher; Kerr, Russell G. Auyuittuqamides A-D, Cyclic Decapeptides from Sesquicillium microsporum RKAG 186 Isolated from Frobisher Bay Sediment Journal of Natural Products 2021 84 (1) 56-60. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.0c00966 | PMID | 33356241 |
