Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013019
PROPERTIES
| NPAID | NPA013019 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | Scoparasin B |
| FORMULA | C29H37NO9 |
| MOLECULAR WEIGHT (Da) | 543.6130 |
| ACCURATE MASS (Da) | 543.2468 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Eutypella |
| ORIGIN SPECIES | scoparia PSU-D44 |
| InChIKey | YXSYADYLBHSOLA-PZOHNQLKSA-N |
| InChI | InChI=1S/C29H37NO9/c1-16-7-6-8-20-24(32)28(4,36)17(2)22-21(15-18-9-11-19(37-5)12-10-18)30-25(33)29(20,22)39-26(34)38-14-13-27(3,35)23(16)31/h6,8-14,16-17,20-22,24,32,35-36H,7,15H2,1-5H3,(H,30,33)/b8-6+,14-13+/t16-,17-,20-,21-,22-,24-,27+,28+,29+/m0/s1 |
| SMILES | C[C@H]1C/C=C/[C@H]2[C@@H]([C@]([C@H]([C@@H]3[C@]2(C(=O)N[C@H]3CC4=CC=C(C=C4)OC)OC(=O)O/C=C/[C@@](C1=O)(C)O)C)(C)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pongcharoen, Wipapan; Rukachaisirikul, Vatcharin; Phongpaichit, Souwalak; Rungjindarnai, Nattawut; Sakayaroj, Jariya Pimarane diterpene and cytochalasin derivatives from the endophytic fungus Eutypella scoparia PSU-D44 Journal of Natural Products 2006 69 (5) 856-858. | ||
|---|---|---|---|
| DOI | 10.1021/np0600649 | PMID | 16724861 |
