Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA025115
PROPERTIES
NPAID | NPA025115 |
---|---|
CLUSTER ID | 69 |
NODE ID | 64 |
NAME | Tomophagusin B |
FORMULA | C32H44O6 |
MOLECULAR WEIGHT (Da) | 524.6980 |
ACCURATE MASS (Da) | 524.3138 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Tomophagus |
ORIGIN SPECIES | sp. |
InChIKey | VDKSDWRGGWZTPZ-UANBTYQASA-N |
InChI | InChI=1S/C32H44O6/c1-19-8-10-25(37-28(19)35)20(2)22-12-15-31(7)23-9-11-26(29(4,5)38-21(3)33)32(17-14-27(34)36-18-32)24(23)13-16-30(22,31)6/h8-9,13,20,22,25-26H,10-12,14-18H2,1-7H3/t20-,22+,25-,26-,30+,31-,32-/m0/s1 |
SMILES | CC1=CC[C@H](OC1=O)[C@@H](C)[C@H]2CC[C@@]3([C@@]2(CC=C4C3=CC[C@H]([C@]45CCC(=O)OC5)C(C)(C)OC(=O)C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Isaka M; Chinthanom P; Thummarukcharoen T; Boonpratuang T; Choowong W Highly Modified Lanostane Triterpenes from Fruiting Bodies of the Basidiomycete Tomophagus sp. Journal of Natural Products 2019 82 (5) 1165-1176. | ||
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DOI | 10.1021/acs.jnatprod.8b00869 | PMID | 30983350 |