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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10O4
Molecular Weight 182.1733
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYLENOMYCIN A

SMILES

C[C@@]12O[C@]1(C)C(=O)C(=C)[C@H]2C(O)=O

InChI

InChIKey=HBECYYFDLZZMPL-WLGLDCGKSA-N
InChI=1S/C9H10O4/c1-4-5(7(11)12)8(2)9(3,13-8)6(4)10/h5H,1H2,2-3H3,(H,11,12)/t5-,8-,9+/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H10O4
Molecular Weight 182.1733
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
X902U0148F
Record Status Validated (UNII)
Record Version