Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA000087
PROPERTIES
NPAID | NPA000087 |
---|---|
CLUSTER ID | 77 |
NODE ID | 72 |
NAME | Aranciamycin anhydride |
FORMULA | C36H36O16 |
MOLECULAR WEIGHT (Da) | 724.6680 |
ACCURATE MASS (Da) | 724.2003 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | QQINRESABYUJSC-RSAYQWSXSA-N |
InChI | InChI=1S/C36H36O16/c1-13-15(35(45)52-34(13)44)9-10-21(38)51-29-14(2)50-20(30(47-4)28(29)42)12-49-31-24-18(32(43)36(3,46)33(31)48-5)11-17-23(27(24)41)26(40)22-16(25(17)39)7-6-8-19(22)37/h6-8,11,14,20,28-31,33,37,41-42,46H,9-10,12H2,1-5H3/t14?,20-,28-,29-,30?,31+,33-,36+/m0/s1 |
SMILES | CC1[C@@H]([C@@H](C([C@@H](O1)CO[C@H]2[C@@H]([C@](C(=O)C3=C2C(=C4C(=C3)C(=O)C5=C(C4=O)C(=CC=C5)O)O)(C)O)OC)OC)O)OC(=O)CCC6=C(C(=O)OC6=O)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Nachtigall, Jonny; Schulz, Dirk; Beil, Winfried; Süssmuth, Roderich D; Fiedler, Hans-Peter Aranciamycin anhydride, a new anthracycline-type antibiotic isolated from Streptomyces sp. Tü 6384 Journal of Antibiotics 2010 63 (7) 397-399. | ||
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DOI | 10.1038/ja.2010.59 | PMID | 20551987 |