Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA001384
PROPERTIES
NPAID | NPA001384 |
---|---|
CLUSTER ID | 242 |
NODE ID | 222 |
NAME | Milbemycin β13 |
FORMULA | C31H42O6 |
MOLECULAR WEIGHT (Da) | 510.6710 |
ACCURATE MASS (Da) | 510.2981 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | bingchenggensis |
InChIKey | CKAICYUWGYNDQA-NSJKHJHQSA-N |
InChI | InChI=1S/C31H42O6/c1-19-7-6-8-24(18-32)27-16-29(33)22(4)14-28(27)30(34)35-26-15-25(10-9-20(2)13-19)37-31(17-26)12-11-21(3)23(5)36-31/h6-9,14,16,19,21,23,25-26,32-33H,10-13,15,17-18H2,1-5H3/b7-6-,20-9-,24-8-/t19-,21-,23+,25+,26-,31-/m0/s1 |
SMILES | C[C@H]1CC[C@]2(C[C@@H]3C[C@H](O2)C/C=C(\C[C@H](/C=C\C=C(/C4=CC(=C(C=C4C(=O)O3)C)O)\CO)C)/C)O[C@@H]1C |
ORIGINAL ISOLATION REFERENCE
CITATION | Xiang, Wen-Sheng; Wang, Ji-Dong; Wang, Xiang-Jing; Zhang, Ji Two New β-Class Milbemycins from Streptomyces bingchenggensis: Fermentation, Isolation, Structure Elucidation and Biological Properties Journal of Antibiotics 2007 60 (6) 351-356. | ||
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DOI | 10.1038/ja.2007.47 | PMID | 17617691 |