Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015196
PROPERTIES
| NPAID | NPA015196 |
|---|---|
| CLUSTER ID | 1717 |
| NODE ID | 135 |
| NAME | Nostopeptolide A2 |
| FORMULA | C52H78N10O14 |
| MOLECULAR WEIGHT (Da) | 1067.2520 |
| ACCURATE MASS (Da) | 1066.5699 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Cyanobacterium |
| ORIGIN SPECIES | sp. |
| InChIKey | UEVIIAJOLZZKQH-LHBOKHSSSA-N |
| InChI | InChI=1S/C52H78N10O14/c1-9-11-42(66)60-45(29(6)7)49(72)59-37-26-76-52(75)38-12-10-17-61(38)50(73)36(21-31-13-15-32(63)16-14-31)58-47(70)35(22-41(53)65)56-44(68)24-54-46(69)34(19-28(4)5)55-43(67)23-40(64)33(18-27(2)3)57-48(71)39-20-30(8)25-62(39)51(37)74/h13-16,27-30,33-39,45,63H,9-12,17-26H2,1-8H3,(H2,53,65)(H,54,69)(H,55,67)(H,56,68)(H,57,71)(H,58,70)(H,59,72)(H,60,66)/t30-,33-,34-,35-,36-,37?,38-,39?,45-/m0/s1 |
| SMILES | CCCC(=O)N[C@@H](C(C)C)C(=O)NC1COC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CC(=O)[C@@H](NC(=O)C3C[C@@H](CN3C1=O)C)CC(C)C)CC(C)C)CC(=O)N)CC4=CC=C(C=C4)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Golakoti, Trimurtulu; Yoshida, Wesley Y.; Chaganty, Sreedhara; Moore, Richard E. Isolation and structures of nostopeptolides A1, A2 and A3 from the cyanobacterium Nostoc sp. GSV224 Tetrahedron 2000 56 (46) 9093-9102. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4020(00)00764-x | PMID | - |
