Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA026622
PROPERTIES
NPAID | NPA026622 |
---|---|
CLUSTER ID | 180 |
NODE ID | 168 |
NAME | Spirotryprostatin G |
FORMULA | C22H25N3O7 |
MOLECULAR WEIGHT (Da) | 443.4560 |
ACCURATE MASS (Da) | 443.1693 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | brasilianum HBU-136 |
InChIKey | VTQUYIHTIIOWPO-LYFVQSQRSA-N |
InChI | InChI=1S/C22H25N3O7/c1-11(2)9-15-21(16(26)13-6-5-12(32-3)10-14(13)23-21)17(27)22(31)19(29)24-8-4-7-20(24,30)18(28)25(15)22/h5-6,9-10,15,17,23,27,30-31H,4,7-8H2,1-3H3/t15-,17-,20+,21+,22+/m0/s1 |
SMILES | COC1=CC2=C(C=C1)C(=O)[C@]1(N2)[C@H](C=C(C)C)N2C(=O)[C@]3(O)CCCN3C(=O)[C@]2(O)[C@H]1O |
ORIGINAL ISOLATION REFERENCE
CITATION | Zhang, Ya-Hui; Geng, Ce; Zhang, Xing-Wang; Zhu, Hua-Jie; Shao, Chang-Lun; Cao, Fei; Wang, Chang-Yun Discovery of Bioactive Indole-Diketopiperazines from the Marine-Derived Fungus Penicillium brasilianum Aided by Genomic Information Marine Drugs 2019 17 (9) None. | ||
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DOI | 10.3390/md17090514 | PMID | 31480589 |