Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014374
PROPERTIES
| NPAID | NPA014374 |
|---|---|
| CLUSTER ID | 4404 |
| NODE ID | 3237 |
| NAME | Aflastatin A |
| FORMULA | C62H115NO24 |
| MOLECULAR WEIGHT (Da) | 1258.5850 |
| ACCURATE MASS (Da) | 1257.7809 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | sp. |
| InChIKey | VAQYWUJSXJULKR-CFVWPHSWSA-N |
| InChI | InChI=1S/C62H115NO24/c1-12-13-14-15-16-17-18-19-38(64)28-62(86)60(84)59(83)57(81)47(87-62)27-46(72)56(80)58(82)55(79)45(71)25-40(66)23-39(65)24-41(67)32(5)50(74)33(6)42(68)26-43(69)34(7)51(75)35(8)52(76)36(9)53(77)44(70)22-30(3)20-29(2)21-31(4)49(73)48-54(78)37(10)63(11)61(48)85/h21,29-30,32-47,50-53,55-60,64-77,79-84,86H,12-20,22-28H2,1-11H3/b31-21+,49-48+/t29?,30?,32?,33?,34?,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?,47-,50?,51?,52?,53?,55?,56?,57-,58?,59+,60+,62+/m1/s1 |
| SMILES | CCCCCCCCCC(C[C@]1([C@H]([C@H]([C@@H]([C@H](O1)CC(C(C(C(C(CC(CC(CC(C(C)C(C(C)C(CC(C(C)C(C(C)C(C(C)C(C(CC(C)CC(C)/C=C(\C)/C(=C\2/C(=O)C(N(C2=O)C)C)/O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ono, Makoto; Sakuda, Shohei; Suzuki, Akinori; Isogai, Akira Aflastatin A, a novel inhibitor of aflatoxin production by aflatoxigenic fungi Journal of Antibiotics 1997 50 (2) 111-118. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.50.111 | PMID | 9099219 |
