Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002854
PROPERTIES
| NPAID | NPA002854 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | Not named |
| FORMULA | C28H33NO7 |
| MOLECULAR WEIGHT (Da) | 495.5720 |
| ACCURATE MASS (Da) | 495.2257 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Mycotypha |
| ORIGIN SPECIES | sp. UMF-006 |
| InChIKey | WDDZJZXADGVZLS-KRQHZRJMSA-N |
| InChI | InChI=1S/C28H33NO7/c1-16-9-8-12-20-23(30)18(3)17(2)22-21(15-19-10-6-5-7-11-19)29-25(32)28(20,22)36-26(33)35-14-13-27(4,34)24(16)31/h5-8,10-14,16,20-23,30,34H,9,15H2,1-4H3,(H,29,32)/b12-8+,14-13+ |
| SMILES | CC1C/C=C/C2C(C(=C(C3C2(C(=O)NC3CC4=CC=CC=C4)OC(=O)O/C=C/C(C1=O)(C)O)C)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Takamatsu, Satoshi; Zhang, Qinglin; Schrader, Kevin K.; ElSohly, Hala N.; Walker, Larry A. Characterization of Mycotypha metabolites found to be inhibitors of cell adhesion molecules Journal of Antibiotics 2002 55 (6) 585-592. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.55.585 | PMID | 12195965 |
