Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA014294
PROPERTIES
| NPAID | NPA014294 |
|---|---|
| CLUSTER ID | 71 |
| NODE ID | 66 |
| NAME | Communesin D |
| FORMULA | C32H34N4O3 |
| MOLECULAR WEIGHT (Da) | 522.6490 |
| ACCURATE MASS (Da) | 522.2631 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Penicillium |
| ORIGIN SPECIES | sp. |
| InChIKey | BKJFWWFPUSKVTE-XJCYDXEVSA-N |
| InChI | InChI=1S/C32H34N4O3/c1-4-5-6-14-24(38)34-17-15-31-21-11-7-8-12-22(21)33-28-32(31)16-18-35(29(31)34)26(27-30(2,3)39-27)20-10-9-13-23(25(20)32)36(28)19-37/h4-14,19,26-29,33H,15-18H2,1-3H3/b5-4+,14-6+/t26-,27+,28+,29+,31-,32-/m1/s1 |
| SMILES | C/C=C/C=C/C(=O)N1CC[C@@]23[C@@H]1N4CC[C@@]25[C@@H](NC6=CC=CC=C36)N(C7=CC=CC(=C57)[C@@H]4[C@H]8C(O8)(C)C)C=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Jadulco, Raquel; Edrada, Ru Angelie; Ebel, Rainer; Berg, Albrecht; Schaumann, Karsten; Wray, Victor; Steube, Klaus; Proksch, Peter New Communesin Derivatives from the Fungus Penicillium sp. Derived from the Mediterranean Sponge Axinella verrucosa Journal of Natural Products 2004 67 (1) 78-81. | ||
|---|---|---|---|
| DOI | 10.1021/np030271y | PMID | 14738391 |
