Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA009636
PROPERTIES
NPAID | NPA009636 |
---|---|
CLUSTER ID | 1138 |
NODE ID | 972 |
NAME | Eremophilene |
FORMULA | C15H24 |
MOLECULAR WEIGHT (Da) | 204.3570 |
ACCURATE MASS (Da) | 204.1878 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Sorangium |
ORIGIN SPECIES | cellulosum So ce56 |
InChIKey | QEBNYNLSCGVZOH-IPYPFGDCSA-N |
InChI | InChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h7,12-13H,1,5-6,8-10H2,2-4H3/t12-,13+,15+/m1/s1 |
SMILES | C[C@@H]1CCC=C2[C@]1(C[C@H](CC2)C(=C)C)C |
ORIGINAL ISOLATION REFERENCE
CITATION | Hochmannova, J; Herout, V On terpenes. CLXIX. Structure of eremophilene Collection of Czechoslovak Chemical Communications 1964 29 (10) 2369-2376. | ||
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DOI | 10.1135/cccc19642369 | PMID | - |