Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA008161
PROPERTIES
NPAID | NPA008161 |
---|---|
CLUSTER ID | 3545 |
NODE ID | 2673 |
NAME | Ajudazol A |
FORMULA | C34H42N2O7 |
MOLECULAR WEIGHT (Da) | 590.7170 |
ACCURATE MASS (Da) | 590.2992 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Chondromyces |
ORIGIN SPECIES | crocatus |
InChIKey | CIWQMSHQAVWNOO-OPGPRAPUSA-N |
InChI | InChI=1S/C34H42N2O7/c1-22-16-17-27-29(30(22)38)34(40)43-32(31(27)39)24(3)19-26-21-42-33(35-26)23(2)15-13-11-9-7-8-10-12-14-18-36(5)28(37)20-25(4)41-6/h7,9,11-14,16-17,20-21,24,31-32,38-39H,2,8,10,15,18-19H2,1,3-6H3/b9-7-,13-11-,14-12+,25-20+/t24-,31+,32-/m0/s1 |
SMILES | CC1=C(C2=C(C=C1)[C@H]([C@@H](OC2=O)[C@@H](C)CC3=COC(=N3)C(=C)C/C=C\C=C/CC/C=C/CN(C)C(=O)/C=C(\C)/OC)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Jansen, Rolf; Kunze, Brigitte; Reichenbach, Hans; Höfle, Gerhard The Ajudazols A and B, Novel Isochromanones from Chondromyces crocatus (Myxobacteria): Isolation and Structure Elucidation European Journal of Organic Chemistry 2002 2002 (5) 917-921. | ||
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DOI | 10.1002/1099-0690(200203)2002:5<917::aid-ejoc917>3.0.co;2-z | PMID | - |