Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA025023
PROPERTIES
| NPAID | NPA025023 |
|---|---|
| CLUSTER ID | 17 |
| NODE ID | 17 |
| NAME | Tolypocladin I |
| FORMULA | C37H51NO8 |
| MOLECULAR WEIGHT (Da) | 637.8140 |
| ACCURATE MASS (Da) | 637.3615 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Tolypocladium |
| ORIGIN SPECIES | sp. XL115 |
| InChIKey | ZMDRKHHGUIZHEC-ANDMQSNYSA-N |
| InChI | InChI=1S/C37H51NO8/c1-31(2,40)22(39)16-18-10-9-11-21-24(18)20-17-19-12-15-36(41)34(7,35(19,8)26(20)38-21)14-13-23-37(36)28(45-37)25-27(42-23)32(3,4)46-30(43-25)29-33(5,6)44-29/h9-11,19,22-23,25,27-30,38-41H,12-17H2,1-8H3/t19-,22-,23-,25+,27-,28+,29+,30-,34+,35+,36-,37-/m0/s1 |
| SMILES | C[C@]12CC[C@H]3[C@@]4([C@@]1(CC[C@@H]5[C@@]2(C6=C(C5)C7=C(C=CC=C7N6)C[C@@H](C(C)(C)O)O)C)O)[C@H](O4)[C@H]8[C@H](O3)C(O[C@H](O8)[C@@H]9C(O9)(C)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 |
