Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018947
PROPERTIES
| NPAID | NPA018947 |
|---|---|
| CLUSTER ID | 3544 |
| NODE ID | 2671 |
| NAME | Arthrichitin |
| FORMULA | C33H46N4O9 |
| MOLECULAR WEIGHT (Da) | 642.7500 |
| ACCURATE MASS (Da) | 642.3265 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Arthrinium |
| ORIGIN SPECIES | phaeospermum (HIL Y-903022) |
| InChIKey | VNRAPWIEXZLTKI-UHFFFAOYSA-N |
| InChI | InChI=1S/C33H46N4O9/c1-4-5-6-7-8-9-12-19(2)29-20(3)30(42)35-24(15-16-26(39)40)31(43)37-27(32(44)36-25(18-38)33(45)46-29)28(41)22-17-34-23-14-11-10-13-21(22)23/h10-11,13-14,17,19-20,24-25,27,29,34,38H,4-9,12,15-16,18H2,1-3H3,(H,35,42)(H,36,44)(H,37,43)(H,39,40) |
| SMILES | CCCCCCCCC(C)C1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O1)CO)C(=O)C2=CNC3=CC=CC=C32)CCC(=O)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Vijayakumar; Roy, Kirity; Chatterjee, Sugata; Deshmukh; Ganguli; Fehlhaber; Kogler Arthrichitin. A new cell wall active metabolite from Arthrinium phaeospermum Journal of Organic Chemistry 1996 61 (19) 6591-6593. | ||
|---|---|---|---|
| DOI | 10.1021/jo960769n | PMID | 11667526 |
