Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA019446
PROPERTIES
| NPAID | NPA019446 |
|---|---|
| CLUSTER ID | 5072 |
| NODE ID | 3633 |
| NAME | Lyngbyastatin 2 |
| FORMULA | C56H94N6O13 |
| MOLECULAR WEIGHT (Da) | 1059.3970 |
| ACCURATE MASS (Da) | 1058.6879 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lyngbya |
| ORIGIN SPECIES | majuscula |
| InChIKey | VXNKUFHPWIHJDR-CFYHMXAFSA-N |
| InChI | InChI=1S/C56H94N6O13/c1-18-35(7)49-53(68)60(15)47(33(3)4)52(67)57(12)43(32-72-16)51(66)61-29-21-24-41(61)50(65)59(14)48(34(5)6)54(69)62-30-22-25-42(62)56(71)75-40(19-2)23-20-26-44(63)38(10)55(70)74-39(11)36(8)27-28-37(9)45(73-17)31-46(64)58(49)13/h28,31,33-36,38-44,47-49,63H,18-27,29-30,32H2,1-17H3/t35-,36-,38+,39+,40+,41-,42-,43-,44+,47-,48-,49-/m0/s1 |
| SMILES | CC[C@@H]1CCC[C@H]([C@H](C(=O)O[C@@H]([C@H](CC=C(C(=CC(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N3CCC[C@H]3C(=O)O1)C(C)C)C)COC)C)C(C)C)C)[C@@H](C)CC)C)OC)C)C)C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Luesch, H; Yoshida, W Y; Moore, R E; Paul, V J Lyngbyastatin 2 and norlyngbyastatin 2, analogues of dolastatin G and nordolastatin G from the marine cyanobacterium Lyngbya majuscula Journal of Natural Products 1999 62 (12) 1702-1706. | ||
|---|---|---|---|
| DOI | 10.1021/np990310z | PMID | 10654420 |
