Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA015700
PROPERTIES
| NPAID | NPA015700 |
|---|---|
| CLUSTER ID | 18 |
| NODE ID | 18 |
| NAME | SQ-02-S-L1 |
| FORMULA | C56H74N2O12 |
| MOLECULAR WEIGHT (Da) | 967.2100 |
| ACCURATE MASS (Da) | 966.5242 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Stachybotrys |
| ORIGIN SPECIES | sp. RF-7260 |
| InChIKey | MAVPMSYXHOEOLG-CBOQOVJRSA-N |
| InChI | InChI=1S/C56H74N2O12/c1-29-14-16-42-51(5,6)44(67-31(3)59)18-20-55(42)53(29,9)25-35-40(61)23-33-37(46(35)69-55)27-57(48(33)63)22-12-11-13-39(50(65)66)58-28-38-34(49(58)64)24-41(62)36-26-54(10)30(2)15-17-43-52(7,8)45(68-32(4)60)19-21-56(43,54)70-47(36)38/h23-24,29-30,39,42-45,61-62H,11-22,25-28H2,1-10H3,(H,65,66)/t29-,30-,39?,42-,43-,44-,45-,53+,54+,55-,56-/m0/s1 |
| SMILES | C[C@H]1CC[C@@H]2[C@]3([C@@]1(CC4=C(C=C5C(=C4O3)CN(C5=O)CCCCC(C(=O)O)N6CC7=C8C(=C(C=C7C6=O)O)C[C@@]9([C@H](CC[C@@H]1[C@@]9(O8)CC[C@@H](C1(C)C)OC(=O)C)C)C)O)C)CC[C@@H](C2(C)C)OC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Minagawa, Kazuyuki; Kouzuki, Shuichi; Tani, Hiroyoshi; Ishii, Kikuo; Tanimoto, Tatsuo; Terui, Yoshihiro; Kamigauchi, Toshiyuki Novel stachyflin derivatives from Stachybotrys sp. RF-7260. Fermentation, isolation, structure elucidation and biological activities Journal of Antibiotics 2002 55 (3) 239-248. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.55.239 | PMID | 12014438 |
