Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025019
PROPERTIES
| NPAID | NPA025019 |
|---|---|
| CLUSTER ID | 17 |
| NODE ID | 17 |
| NAME | Tolypocladin E |
| FORMULA | C37H50ClNO6 |
| MOLECULAR WEIGHT (Da) | 640.2610 |
| ACCURATE MASS (Da) | 639.3327 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Tolypocladium |
| ORIGIN SPECIES | sp. XL115 |
| InChIKey | OBPUTJWEHDHPHS-LDVZNYFHSA-N |
| InChI | InChI=1S/C37H50ClNO6/c1-19(2)16-26-43-28-30(33(5,6)44-26)42-25-13-14-34(7)35(8)21(12-15-36(34,41)37(25)31(28)45-37)18-22-27-20(17-24(40)32(3,4)38)10-9-11-23(27)39-29(22)35/h9-11,16,21,24-26,28,30-31,39-41H,12-15,17-18H2,1-8H3/t21-,24-,25-,26-,28+,30-,31+,34+,35+,36-,37-/m0/s1 |
| SMILES | CC(=C[C@H]1O[C@H]2[C@@H]3[C@@]4(O3)[C@H](CC[C@]5([C@]4(CC[C@@H]6[C@@]5(C7=C(C6)C8=C(C=CC=C8N7)C[C@@H](C(C)(C)Cl)O)C)O)C)O[C@@H]2C(O1)(C)C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Xu LL; Hai P; Zhang SB; Xiao JF; Gao Y; Ma BJ; Fu HY; Chen YM; Yang XL Prenylated Indole Diterpene Alkaloids from a Mine-Soil-Derived Tolypocladium sp. Journal of Natural Products 2019 82 (2) 221-231. | ||
|---|---|---|---|
| DOI | 10.1021/acs.jnatprod.8b00589 | PMID | 30702286 |
