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(Q110170278)
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English
Cis-[2-(4,5-dihydroxy-4-methylhexyl)cyclopropyl]-acetic acid
group of stereoisomers with the chemical formula C₁₂H₂₂O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
230.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₂₂O₄
0 references
canonical SMILES
O=C(O)CC1CC1CCCC(O)(C)C(O)C
0 references
isomeric SMILES
CC(O)C(C)(O)CCC[C@@H]1C[C@@H]1CC(=O)O
0 references
found in taxon
Streptomyces
1 reference
stated in
Derivatives of Holomycin and Cyclopropaneacetic Acid from Streptomyces sp. DT-A37.
Identifiers
InChI
InChI=1S/C12H22O4/c1-8(13)12(2,16)5-3-4-9-6-10(9)7-11(14)15/h8-10,13,16H,3-7H2,1-2H3,(H,14,15)/t8?,9-,10-,12?/m1/s1
0 references
InChIKey
VXAQATSKSFDXMV-WDHPUFTPSA-N
0 references
PubChem CID
156581428
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VXAQATSKSFDXMV-WDHPUFTPSA-N
ChEBI ID
206274
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H22O4/c1-8(13)12(2,16)5-3-4-9-6-10(9)7-11(14)15/h8-10,13,16H,3-7H2,1-2H3,(H,14,15)/t8?,9-,10-,12?/m1/s1
Natural Product Atlas ID
NPA030310
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VXAQATSKSFDXMV-WDHPUFTPSA-N
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