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Chemical structure

Melledonal C


CID Molecular formula Molecular weight Canonical smiles Isomeric smiles Exact mass
189493 C24H29ClO8 480.9 CC1=C(C(=CC(=C1Cl)OC )O)C(=O)OC2CC3(C2(C( =CC4(C3C(C(C4)(C)C)O )O)C=O)O)C CC1=C(C(=CC(=C1Cl)OC)O)C(=O)O[C@@H]2C[C@]3([C@@]2(C(=C[C@]4([C@@H]3[C@H](C(C4)(C)C)O)O)C=O)O)C 480.155096
SMILES:

Synonym

Synonym
Melledonal C
117458-35-2
CHEMBL1078144
CTK4B0294
DTXSID70922427
Benzoic acid,3-chloro-6-hydroxy-4-methoxy-2-methyl-,(2R,2aS,4aR,7R,7aS,7bR)-3-formyl-2,2a,4a,5,6,7,7a,7b-octahydro-2a,4a,7-trihydroxy-6,6,7b-trimethyl-1H-cyclobut[e]inden-2-ylester
[(2R,2aS,4aR,7R,7aS,7bR)-3-formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 3-chloro-6-hydroxy-4-methoxy-2-methyl-benzoate
3-Formyl-2a,4a,7-trihydroxy-6,6,7b-trimethyl-2,2a,4a,5,6,7,7a,7b-octahydro-1H-cyclobuta[e]inden-2-yl 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoate
Benzoic acid, 3-chloro-6-hydroxy-4-methoxy-2-methyl-,3-formyl-2,2a,4a,5,6,7,7a,7b-octahydro-2a,4a,7-trihydroxy-6,6,7b-trimethyl-1H-cyclobut(e)inden-2-yl ester, (2R-(2alpha,2abeta,4aalpha,7beta,7aalpha,7bbeta))-

Microbial origin

Microorganism group Scientific Name Reference Source
Fungi Armillaria mellea PMID:19795841
NPASS