Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA027184
PROPERTIES
| NPAID | NPA027184 |
|---|---|
| CLUSTER ID | 18 |
| NODE ID | 18 |
| NAME | Bistachybotrysin D |
| FORMULA | C47H64O9 |
| MOLECULAR WEIGHT (Da) | 773.0200 |
| ACCURATE MASS (Da) | 772.4550 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Stachybotrys |
| ORIGIN SPECIES | chartarum CGMCC 3.5365 |
| InChIKey | MNXSMYRWPCDCOZ-AWYSNFIASA-N |
| InChI | InChI=1S/C47H64O9/c1-23-10-12-31-42(3,4)33(51)14-16-44(31,7)46(23)20-27-29(49)18-25(22-48)35(39(27)55-46)37-38(53)26-19-30(50)28-21-47(56-40(28)36(26)41(37)54-9)24(2)11-13-32-43(5,6)34(52)15-17-45(32,47)8/h18-19,23-24,31-34,37,41,48-52H,10-17,20-22H2,1-9H3/t23-,24-,31+,32+,33-,34-,37+,41+,44+,45+,46-,47-/m1/s1 |
| SMILES | CO[C@H]1C2=C3O[C@]4(CC3=C(O)C=C2C(=O)[C@@H]1C1=C2O[C@]3(CC2=C(O)C=C1CO)[C@H](C)CC[C@H]1C(C)(C)[C@H](O)CC[C@@]13C)[C@H](C)CC[C@H]1C(C)(C)[C@H](O)CC[C@@]14C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zhang, Min; Feng, Jiamin; Jia, Xiaona; Zhao, Jinlian; Liu, Jimei; Chen, Ridao; Xie, Kebo; Chen, Dawei; Li, Yan; Zhang, Dan; Dai, Jungui Bistachybotrysins D and E, one stereoisomeric pair of cytotoxic phenylspirodrimane dimers from Stachybotrys chartarum Chinese Chemical Letters 2019 435-438. | ||
|---|---|---|---|
| DOI | 10.1016/j.cclet.2018.04.031 | PMID | - |
