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(Q76386691)
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English
(4R,5R,8R,9E)-9-ethylidene-5,8-dihydroxy-4-propyl-5,7,8,10-tetrahydro-4H-cyclonona[c]furan-1,3,6-trione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
308.12598835999995
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
CID 10892197
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
14-dihydroxycornestin
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₆H₂₀O₆
0 references
canonical SMILES
CC=C1CC2=C(C(=O)OC2=O)C(CCC)C(O)C(=O)CC1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCC[C@H]1[C@H](C(=O)C[C@H](/C(=C/C)/CC2=C1C(=O)OC2=O)O)O
0 references
Identifiers
InChI
InChI=1S/C16H20O6/c1-3-5-9-13-10(15(20)22-16(13)21)6-8(4-2)11(17)7-12(18)14(9)19/h4,9,11,14,17,19H,3,5-7H2,1-2H3/b8-4+/t9-,11-,14-/m1/s1
0 references
InChIKey
ILMHTGUGRLGMCR-UJCPQBBRSA-N
0 references
PubChem CID
6439145
1 reference
matched by identifier from
InChIKey
InChIKey
ILMHTGUGRLGMCR-UJCPQBBRSA-N
UniChem compound ID
55215895
1 reference
stated in
UniChem
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