Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA025410
PROPERTIES
NPAID | NPA025410 |
---|---|
CLUSTER ID | 327 |
NODE ID | 266 |
NAME | Asperophiobolin E |
FORMULA | C25H34O3 |
MOLECULAR WEIGHT (Da) | 382.5440 |
ACCURATE MASS (Da) | 382.2508 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Aspergillus |
ORIGIN SPECIES | sp. ZJ-68 |
InChIKey | SQPAMJOSHZSSOT-IPNGRVRVSA-N |
InChI | InChI=1S/C25H34O3/c1-15(2)7-6-8-16(3)18-11-12-25(5)14-20-17(4)13-22(26)23(20)19(24(27)28)9-10-21(18)25/h6-9,13,16,18,20-21,23H,10-12,14H2,1-5H3,(H,27,28)/b8-6-,19-9+/t16-,18+,20+,21-,23-,25+/m0/s1 |
SMILES | CC1=CC(=O)[C@@H]/2[C@@H]1C[C@]3(CC[C@@H]([C@@H]3C/C=C2/C(=O)O)[C@@H](C)/C=C\C=C(C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Cai R; Jiang H; Mo Y; Guo H; Li C; Long Y; Zang Z; She Z Ophiobolin-Type Sesterterpenoids from the Mangrove Endophytic Fungus Aspergillus sp. ZJ-68. Journal of Natural Products 2019 82 (8) 2268-2278. | ||
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DOI | 10.1021/acs.jnatprod.9b00462 | PMID | 31365251 |