Concept information
Preferred term
AA 57
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C15H17ClO5
inchi
- InChI=1S/C15H17ClO5/c1-7-4-14-10(8(7)2)3-9(12(17)18)11(14)5-21-13(19)15(14,20)6-16/h3-4,8,10-11,20H,5-6H2,1-2H3,(H,17,18)/t8?,10-,11+,14?,15-/m1/s1
inchikey
- JIBVJJZCSYJNBC-UJICEISBSA-N
mass
- 312.750
monoisotopicmass
- 312.07645
smiles
- ClC[C@@]1(O)C(=O)OC[C@@H]2C13C=C(C)C([C@H]3C=C2C(=O)O)C
subset
- 2_STAR
synonym EXACT
- (1S,4aR,6aR)-1-(chloromethyl)-1-hydroxy-7,8-dimethyl-2-oxo-4,4a,6a,7-tetrahydropentaleno[1,6a-c]pyran-5-carboxylic acid
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:223758
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