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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20O6
Molecular Weight 308.3264
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONOCERIN

SMILES

[H][C@@]12C[C@H](CCC)O[C@]1([H])C3=CC(OC)=C(OC)C(O)=C3C(=O)O2

InChI

InChIKey=VAYQNUBOZLPGDH-OLXJLDBKSA-N
InChI=1S/C16H20O6/c1-4-5-8-6-11-14(21-8)9-7-10(19-2)15(20-3)13(17)12(9)16(18)22-11/h7-8,11,14,17H,4-6H2,1-3H3/t8-,11+,14+/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H20O6
Molecular Weight 308.3264
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
G7C424U3DJ
Record Status Validated (UNII)
Record Version