Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000478460 | Silver | Sclerotiamide_130024 |
COMPOUND NPA013939
PROPERTIES
| NPAID | NPA013939 |
|---|---|
| CLUSTER ID | 193 |
| NODE ID | 181 |
| NAME | Sclerotiamide |
| FORMULA | C26H29N3O5 |
| MOLECULAR WEIGHT (Da) | 463.5340 |
| ACCURATE MASS (Da) | 463.2107 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | sclerotiorum |
| InChIKey | CFJMAERFDLWMJL-LQKPOZSPSA-N |
| InChI | InChI=1S/C26H29N3O5/c1-22(2)10-8-13-15(34-22)7-6-14-17(13)27-20(32)25(14)18(30)26-16(23(25,3)4)12-24(19(31)28-26)9-5-11-29(24)21(26)33/h6-8,10,16,18,30H,5,9,11-12H2,1-4H3,(H,27,32)(H,28,31)/t16-,18-,24-,25-,26+/m0/s1 |
| SMILES | CC1(C=CC2=C(O1)C=CC3=C2NC(=O)[C@@]34[C@@H]([C@]56[C@H](C4(C)C)C[C@@]7(CCCN7C5=O)C(=O)N6)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Whyte, Authrine C.; Gloer, James B.; Wicklow, Donald T.; Dowd, Patrick F. Sclerotiamide: A New Member of the Paraherquamide Class with Potent Antiinsectan Activity from the Sclerotia ofAspergillus sclerotiorum Journal of Natural Products 1996 59 (11) 1093-1095. | ||
|---|---|---|---|
| DOI | 10.1021/np960607m | PMID | 8946752 |
SYNTHESES
| CITATION 1 | Zhang B; Zheng W; Wang X; Sun D; Li C Total Synthesis of Notoamides F, I, and R and Sclerotiamide. Angewandte Chemie International Edition 2016 55 (35) 10435-8. DOI: 10.1002/anie.201604754 PMID: 27443750 | ||
|---|---|---|---|
