Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA000449
PROPERTIES
NPAID | NPA000449 |
---|---|
CLUSTER ID | 349 |
NODE ID | 315 |
NAME | Indoxamycin F |
FORMULA | C22H30O4 |
MOLECULAR WEIGHT (Da) | 358.4780 |
ACCURATE MASS (Da) | 358.2144 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | KGHZJTNBQYMYSR-KIMKDBTQSA-N |
InChI | InChI=1S/C22H30O4/c1-8-12(2)18-21(6)11-13(3)16-20(5,10-9-15(23)24)17(25)14(4)19(26-18)22(16,21)7/h8-11,16-19,25H,4H2,1-3,5-7H3,(H,23,24)/b10-9+,12-8-/t16-,17-,18-,19+,20+,21+,22-/m1/s1 |
SMILES | C/C=C(/C)\[C@@H]1[C@@]2(C=C([C@H]3[C@@]2([C@@H](O1)C(=C)[C@H]([C@@]3(C)/C=C/C(=O)O)O)C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Sato, Seizo; Iwata, Fumie; Mukai, Takako; Yamada, Shoichi; Takeo, Jiro; Abe, Akihisa; Kawahara, Hiroyuki Indoxamycins A-F. Cytotoxic tricycklic polypropionates from a marine-derived actinomycete Journal of Organic Chemistry 2009 74 (15) 5502-5509. | ||
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DOI | 10.1021/jo900667j | PMID | 19572603 |