Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000424864 | Gold | 3 |
| CCMSLIB00000424865 | Gold | 3 |
COMPOUND NPA027325
PROPERTIES
| NPAID | NPA027325 |
|---|---|
| CLUSTER ID | 7432 |
| NODE ID | 5083 |
| NAME | Scytophycin D |
| FORMULA | C45H75NO12 |
| MOLECULAR WEIGHT (Da) | 822.0900 |
| ACCURATE MASS (Da) | 821.5289 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Scytonema |
| ORIGIN SPECIES | pseudohofmannii BC-1-2 |
| InChIKey | DWQQWNRHLJPIDV-OAJWNAMCSA-N |
| InChI | InChI=1S/C45H75NO12/c1-28-16-19-34(48)24-35-14-13-15-36(57-35)25-39(54-10)45(7,52)40(55-11)26-38(53-9)32(5)44(58-41(50)21-17-28)33(6)42(51)29(2)18-20-37(49)31(4)43(56-12)30(3)22-23-46(8)27-47/h13-14,16-17,21-23,27,29-36,38-40,42-44,48,51-52H,15,18-20,24-26H2,1-12H3/b21-17+,23-22+,28-16+/t29-,30+,31-,32-,33-,34-,35-,36-,38+,39-,40-,42-,43+,44-,45-/m0/s1 |
| SMILES | CO[C@H]1C[C@@H]2CC=C[C@@H](C[C@@H](O)C/C=C(C)/C=C/C(=O)O[C@H]([C@@H](C)[C@@H](O)[C@@H](C)CCC(=O)[C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]1(C)O)O2 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ishibashi M; Moore R; Patterson G; Xu C; Clardy J Scytophycins, cytotoxic and antimycotic agents from the cyanophyte Scytonema pseudohofmanni Journal of Organic Chemistry 1986 51 (26) 5300-5306. | ||
|---|---|---|---|
| DOI | 10.1021/jo00376a047 | PMID | - |
