Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033153
PROPERTIES
| NPAID | NPA033153 |
|---|---|
| CLUSTER ID | 7525 |
| NODE ID | 96 |
| NAME | Dendrothelin A |
| FORMULA | C67H111N13O13 |
| MOLECULAR WEIGHT (Da) | 1306.7030 |
| ACCURATE MASS (Da) | 1305.8424 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Dendrothele |
| ORIGIN SPECIES | bispora |
| InChIKey | ICHIUSBXAKDGBC-JMAUXVECSA-N |
| InChI | InChI=1S/C67H111N13O13/c1-24-40(12)52-63(89)78(21)55(39(10)11)66(92)80(23)58(43(15)81)65(91)74(17)35-50(84)75(18)57(42(14)26-3)67(93)77(20)53(37(6)7)59(85)69-33-48(82)71-51(36(4)5)62(88)79(22)56(41(13)25-2)64(90)73(16)34-49(83)70-47(31-44-32-68-46-30-28-27-29-45(44)46)61(87)76(19)54(38(8)9)60(86)72-52/h27-30,32,36-43,47,51-58,68,81H,24-26,31,33-35H2,1-23H3,(H,69,85)(H,70,83)(H,71,82)(H,72,86)/t40-,41-,42-,43+,47-,51+,52-,53+,54+,55+,56-,57-,58-/m0/s1 |
| SMILES | CC[C@H](C)[C@@H]1NC(=O)[C@@H](C(C)C)N(C)C(=O)[C@H](CC2=C[NH]C3=CC=CC=C23)NC(=O)CN(C)C(=O)[C@H]([C@@H](C)CC)N(C)C(=O)[C@@H](C(C)C)NC(=O)CNC(=O)[C@@H](C(C)C)N(C)C(=O)[C@H]([C@@H](C)CC)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)N(C)C(=O)[C@@H](C(C)C)N(C)C1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Matabaro, Emmanuel; Kaspar, Hannelore; Dahlin, Paul; Bader, Daniel L. V.; Murar, Claudia E.; Staubli, Florian; Field, Christopher M.; Bode, Jeffrey W.; Künzler, Markus Identification, heterologous production and bioactivity of lentinulin A and dendrothelin A, two natural variants of backbone N-methylated peptide macrocycle omphalotin A Scientific Reports 2021 11 (1) None. | ||
|---|---|---|---|
| DOI | 10.1038/s41598-021-83106-2 | PMID | 33574430 |
