Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA022090
PROPERTIES
| NPAID | NPA022090 |
|---|---|
| CLUSTER ID | 394 |
| NODE ID | 11 |
| NAME | Versiquinazoline H |
| FORMULA | C25H24N4O4 |
| MOLECULAR WEIGHT (Da) | 444.4910 |
| ACCURATE MASS (Da) | 444.1798 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | versicolor LZD-14-1 |
| InChIKey | UUHMOOKGLMRCGV-FJVADALBSA-N |
| InChI | InChI=1S/C25H24N4O4/c1-3-14(2)20-23(32)28-18-11-7-5-9-16(18)25(33)12-19(22(31)29(20)24(25)28)27-13-26-17-10-6-4-8-15(17)21(27)30/h4-11,13-14,19-20,24,33H,3,12H2,1-2H3/t14-,19+,20-,24-,25+/m0/s1 |
| SMILES | CC[C@H](C)[C@H]1C(=O)N2C3=CC=CC=C3[C@]3(O)C[C@@H](N4C=NC5=CC=CC=C5C4=O)C(=O)N1[C@H]23 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Cheng, Zhongbin; Lou, Lanlan; Liu, Dong; Li, Xiaodan; Proksch, Peter; Yin, Sheng; Lin, Wenhan Versiquinazolines A-K, Fumiquinazoline-Type Alkaloids from the Gorgonian-Derived Fungus Aspergillus versicolor LZD-14-1 Journal of Natural Products 2016 79 (11) 2941-2952. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.6b00801 | PMID | 27933898 |
REVISIONS
| VERSION | SMILES | CITATION | ||
|---|---|---|---|---|
| Original Isolation | CCC(C)[C@@H]1C(=O)N2[C@@H]3N1C(=O)[C@H](C[C@@]3(C4=CC=CC=C42)O)N5C=NC6=CC=CC=C6C5=O | Cheng, Zhongbin; Lou, Lanlan; Liu, Dong; Li, Xiaodan; Proksch, Peter; Yin, Sheng; Lin, Wenhan Versiquinazolines A-K, Fumiquinazoline-Type Alkaloids from the Gorgonian-Derived Fungus Aspergillus versicolor LZD-14-1 Journal of Natural Products 2016 79 (11) 2941-2952. DOI: 10.1021/acs.jnatprod.6b00801 PMID: 27933898 | ||
| 2 | CC[C@H](C)[C@H]1C(=O)N2C3=CC=CC=C3[C@]3(O)C[C@@H](N4C=NC5=CC=CC=C5C4=O)C(=O)N1[C@H]23 | Wu, Jiang-Feng; Huang, Pei-Qiang Concise, enantioselective total syntheses of both the proposed and revised structures of (−)-versiquinazoline H Chinese Chemical Letters 2020 31 (1) 61-63. DOI: 10.1016/j.cclet.2019.06.043 | ||
