Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005713
PROPERTIES
| NPAID | NPA005713 |
|---|---|
| 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 | OLBHIGPILGBPMF-ZMQTYWPWSA-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/h5-8,10-14,16-17,20-23,30,34H,3,9,15H2,1-2,4H3,(H,29,32)/b12-8+,14-13+/t16-,17+,20-,21-,22-,23?,27+,28+/m0/s1 |
| SMILES | C[C@H]1C/C=C/[C@H]2C(C(=C)[C@H]([C@@H]3[C@]2(C(=O)N[C@H]3CC4=CC=CC=C4)OC(=O)O/C=C/[C@@](C1=O)(C)O)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 |
