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(Q104995987)
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English
Diosbulbin-D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(1S,2S,5R,10S,11R,13S)-8-(furan-3-yl)-10-methyl-7,14-dioxatetracyclo[11.2.1.02,11.05,10]hexadecane-3,6,15-trione
1 reference
based on heuristic
inferred from SMILES
mass
344.12598836
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1R,2S,5R,8S,10S,11R,13R)-8-(furan-3-yl)-10-methyl-7,14-dioxatetracyclo[11.2.1.02,11.05,10]hexadecane-3,6,15-trione
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₀O₆
0 references
canonical SMILES
O=C1OC2CC1C3C(=O)CC4C(=O)OC(C5=COC=C5)CC4(C)C3C2
0 references
isomeric SMILES
C[C@@]12C[C@@H](c3ccoc3)OC(=O)[C@H]1CC(=O)[C@@H]1[C@H]3C[C@@H](C[C@H]12)OC3=O
0 references
found in taxon
Dioscorea bulbifera
1 reference
stated in
Diosbulbin d and 8-epidiosbulbin e acetate, norclerodane diterpenoids from dioscorea bulbifera tubers
Identifiers
InChI
InChI=1S/C19H20O6/c1-19-7-15(9-2-3-23-8-9)25-18(22)13(19)6-14(20)16-11-4-10(5-12(16)19)24-17(11)21/h2-3,8,10-13,15-16H,4-7H2,1H3/t10-,11+,12+,13+,15-,16+,19-/m0/s1
0 references
InChIKey
FJCWYLRNGKSUCH-OXIVVSFQSA-N
0 references
PubChem CID
21723241
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
52926371
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0035109
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FJCWYLRNGKSUCH-OXIVVSFQSA-N
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