Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA015326
PROPERTIES
NPAID | NPA015326 |
---|---|
CLUSTER ID | 105 |
NODE ID | 100 |
NAME | Squalestatin H6 |
FORMULA | C23H28O12 |
MOLECULAR WEIGHT (Da) | 496.4650 |
ACCURATE MASS (Da) | 496.1581 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Phoma |
ORIGIN SPECIES | sp. C2932 |
InChIKey | NNOAULQCFAVIGM-PFGYURHTSA-N |
InChI | InChI=1S/C23H28O12/c1-12(9-13-5-3-2-4-6-13)10-14(11-24)7-8-21-15(25)16(26)23(35-21,20(31)32)22(33,19(29)30)17(34-21)18(27)28/h2-6,10,12,15-17,24-26,33H,7-9,11H2,1H3,(H,27,28)(H,29,30)(H,31,32)/b14-10-/t12?,15-,16-,17-,21+,22-,23+/m1/s1 |
SMILES | CC(CC1=CC=CC=C1)/C=C(/CC[C@@]23[C@@H]([C@H]([C@@](O2)([C@@]([C@H](O3)C(=O)O)(C(=O)O)O)C(=O)O)O)O)\CO |
ORIGINAL ISOLATION REFERENCE
CITATION | Blows; Foster; Lane; Noble; Piercey; Sidebottom; Webb The squalestatins, novel inhibitors of squalene synthase produced by a species of Phoma. V. Minor metabolites Journal of Antibiotics 1994 47 (7) 740-754. | ||
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DOI | 10.7164/antibiotics.47.740 | PMID | 8071119 |