Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00010112712 | Gold | 3 |
CCMSLIB00010112713 | Gold | 3 |
CCMSLIB00010124036 | Gold | 3 |
CCMSLIB00010124037 | Gold | 3 |
CCMSLIB00005778058 | Gold | 3 |
CCMSLIB00005778225 | Gold | 3 |
CCMSLIB00005778250 | Gold | 3 |
CCMSLIB00005778027 | Gold | 3 |
CCMSLIB00005778015 | Gold | 3 |
COMPOUND NPA012990
PROPERTIES
NPAID | NPA012990 |
---|---|
CLUSTER ID | 58 |
NODE ID | 55 |
NAME | Cytochalasin D |
FORMULA | C30H37NO6 |
MOLECULAR WEIGHT (Da) | 507.6270 |
ACCURATE MASS (Da) | 507.2621 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Metarhizium |
ORIGIN SPECIES | anisopliae |
InChIKey | SDZRWUKZFQQKKV-BBXOWAOSSA-N |
InChI | InChI=1S/C30H37NO6/c1-17-10-9-13-22-26(33)19(3)18(2)25-23(16-21-11-7-6-8-12-21)31-28(35)30(22,25)24(37-20(4)32)14-15-29(5,36)27(17)34/h6-9,11-15,17-18,22-26,33,36H,3,10,16H2,1-2,4-5H3,(H,31,35)/b13-9+,15-14+ |
SMILES | CC1C/C=C/C2C(C(=C)C(C3C2(C(/C=C/C(C1=O)(C)O)OC(=O)C)C(=O)NC3CC4=CC=CC=C4)C)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Aldridge, DC; Turner, WB Structures of cytochalasins C and D Journal of the Chemical Society C: Organic 1969 (6) 923-928. | ||
---|---|---|---|
DOI | 10.1039/j39690000923 | PMID | - |