Results for:
PubChem ID: 185781

[(1S,3aR,4S,6R,7S,7aS)-1,7-diformyl-7a-hydroxy-1,3,3,6-tetramethyl-2,3a,4,5,6,7-hexahydroinden-4-yl] Acetate

Compound Details

Synonymous names	Botrydial AC1L4HIG 2VQE1Z1G8Q AC1Q6A60 UNII-2VQE1Z1G8Q CTK5A2875 CHEMBL476877 C09622 CHEBI:3159 OR066520 OR283388 SCHEMBL7708121 LMPR0103640001 3B1-006109 54986-75-3 (1S,3aR,4S,6R,7S,7aS)-1,7-diformyl-7a-hydroxy-1,3,3,6-tetramethyloctahydro-1H-inden-4-yl acetate (1S,3aR,4S,6R,7S,7aS)-1,7-diformyl-7a-hydroxy-1,3,3,6-tetramethyl-octahydro-1H-inden-4-yl acetate [(1S,3aR,4S,6R,7S,7aS)-1,7-diformyl-7a-hydroxy-1,3,3,6-tetramethyl-2,3a,4,5,6,7-hexahydroinden-4-yl] acetate
Microorganism:	Yes
IUPAC name	[(1S,3aR,4S,6R,7S,7aS)-1,7-diformyl-7a-hydroxy-1,3,3,6-tetramethyl-2,3a,4,5,6,7-hexahydroinden-4-yl] acetate
SMILES	CC1CC(C2C(CC(C2(C1C=O)O)(C)C=O)(C)C)OC(=O)C
Inchi	InChI=1S/C17H26O5/c1-10-6-13(22-11(2)20)14-15(3,4)8-16(5,9-19)17(14,21)12(10)7-18/h7,9-10,12-14,21H,6,8H2,1-5H3/t10-,12+,13+,14+,16-,17-/m1/s1
Formula	C17H26O5
PubChem ID	185781
Molweight	310.39
LogP	0.95
Atoms	48
Bonds	49
H-bond Acceptor	4
H-bond Donor	1
Chemical Classification	terpenes alcohols aldehydes esters

mVOC Specific Details

Microorganisms emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Fungi Botrytis Sp. Fehlhaber et al. 1974
Method	Kingdom Species Growth Medium Applied Method Verification Fungi Botrytis Sp. no