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(Q105162889)
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Sparticolin E
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,3,3a,6a-tetrahydro-2',4'-dioxaspiro[cyclopenta[b]furan-4,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),5',7',9',11'-pentaen-2-ylacetic acid
1 reference
based on heuristic
inferred from SMILES
mass
324.099773612
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₁₆O₅
0 references
canonical SMILES
O=C(O)CC1OC2C=CC3(OC4=CC=CC=5C=CC=C(O3)C45)C2C1
0 references
isomeric SMILES
O=C(O)C[C@@H]1C[C@H]2[C@H](C=CC23Oc2cccc4cccc(c24)O3)O1
0 references
found in taxon
Sparticola junci
1 reference
stated in
Sparticolins A-G, Biologically Active Oxidized Spirodioxynaphthalene Derivatives from the Ascomycete Sparticola junci
Identifiers
InChI
InChI=1S/C19H16O5/c20-17(21)10-12-9-13-14(22-12)7-8-19(13)23-15-5-1-3-11-4-2-6-16(24-19)18(11)15/h1-8,12-14H,9-10H2,(H,20,21)/t12-,13-,14-/m0/s1
0 references
InChIKey
MFOCYSKXKXAQBP-IHRRRGAJSA-N
0 references
PubChem CID
145721248
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
176967325
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA025494
1 reference
based on heuristic
inferred from InChIKey
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