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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H14O6
Molecular Weight 314.2895
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AFLATOXICOL

SMILES

[H][C@]12OC=C[C@@]1([H])C3=C(O2)C=C(OC)C4=C3OC(=O)C5=C4CC[C@@H]5O

InChI

InChIKey=WYIWLDSPNDMZIT-IRWWLHRVSA-N
InChI=1S/C17H14O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h4-6,8-9,17-18H,2-3H2,1H3/t8-,9-,17+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H14O6
Molecular Weight 314.2895
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

PubMed

Substance Class Chemical
Record UNII
45I1K5482V
Record Status Validated (UNII)
Record Version