Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA001824
PROPERTIES
NPAID | NPA001824 |
---|---|
CLUSTER ID | 752 |
NODE ID | 655 |
NAME | Sorbicillamine C |
FORMULA | C28H33NO8 |
MOLECULAR WEIGHT (Da) | 511.5710 |
ACCURATE MASS (Da) | 511.2206 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | sp. F23-2 |
InChIKey | CKKVKBLGPLJNEM-XNLMCKFUSA-N |
InChI | InChI=1S/C28H33NO8/c1-7-9-10-12-16(30)18-20(32)14(3)23(33)26(5)21(18)25(4)24(34)19-17(31)13-15(11-8-2)29-22(19)27(6,35)28(25,36)37-26/h7-12,15,21,30,32,34-36H,13H2,1-6H3/b9-7+,11-8+,12-10+,18-16+/t15-,21+,25+,26-,27-,28+/m0/s1 |
SMILES | C/C=C/C=C/C(=C/1\[C@@H]2[C@@]3(C(=C4C(=O)C[C@@H](N=C4[C@]([C@@]3(O[C@@]2(C(=O)C(=C1O)C)C)O)(C)O)/C=C/C)O)C)/O |
ORIGINAL ISOLATION REFERENCE
CITATION | Guo, Wenqiang; Peng, Jixing; Zhu, Tianjiao; Gu, Qianqun; Keyzers, Robert A.; Li, Dehai Sorbicillamines A-E, nitrogen-containing sorbicillinoids from the deep-sea-derived fungus Penicillium sp. F23-2 Journal of Natural Products 2013 76 (11) 2106-2112. | ||
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DOI | 10.1021/np4006647 | PMID | 24215398 |