Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA032990
PROPERTIES
NPAID | NPA032990 |
---|---|
CLUSTER ID | 9517 |
NODE ID | 6371 |
NAME | Sungeidine G |
FORMULA | C30H21NO5S |
MOLECULAR WEIGHT (Da) | 507.5670 |
ACCURATE MASS (Da) | 507.1140 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Micromonospora |
ORIGIN SPECIES | sp. MD118 |
InChIKey | RQTBDAFTRVNJNV-HNKFSMOOSA-N |
InChI | InChI=1S/C30H21NO5S/c1-10-8-18(34)21-14-9-31-15-5-2-13-23-25(15)20(11-3-6-16(32)26(21)22(11)27(31)19(10)14)12-4-7-17(33)28(35)24(12)29(23)37-30(13)36/h2-8,14,17,19,21,27-28,32-33,35H,9H2,1H3/t14-,17+,19-,21-,27+,28-/m0/s1 |
SMILES | CC1=CC(=O)[C@H]2C3=C(O)C=CC4=C3[C@H]3[C@@H]1[C@@H]2CN3C1=C2C4=C3C=C[C@@H](O)[C@H](O)C3=C3SC(=O)C(=C32)C=C1 |
ORIGINAL ISOLATION REFERENCE
CITATION | Low, Zhen Jie; Ma, Guang-Lei; Tran, Hoa Thi; Zou, Yike; Xiong, Juan; Pang, Limei; Nuryyeva, Selbi; Ye, Hong; Hu, Jin-Feng; Houk, K N; Liang, Zhao-Xun Sungeidines from a Non-canonical Enediyne Biosynthetic Pathway. Journal of the American Chemical Society 2020 142 (4) 1673-1679. | ||
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DOI | 10.1021/jacs.9b10086 | PMID | 31922407 |