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(Q83030617)
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English
12-Acetoxycalanolide A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,3,10,10-tetramethyl-6-oxo-8-propyl-3,4-dihydro-2H-1,5,9-trioxatriphenylen-4-yl acetate
1 reference
based on heuristic
inferred from SMILES
mass
412.188588616
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(4R,5R,6R)-4,5,16,16-tetramethyl-10-oxo-12-propyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),8(13),11,17-pentaen-6-yl] acetate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₄H₂₈O₆
0 references
canonical SMILES
O=C1OC=2C(=C3OC(C=CC3=C4OC(C)C(C)C(OC(=O)C)C24)(C)C)C(=C1)CCC
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isomeric SMILES
CCCC1=CC(=O)OC2=C1C3=C(C=CC(O3)(C)C)C4=C2[C@H]([C@@H]([C@H](O4)C)C)OC(=O)C
0 references
found in taxon
Calophyllum lanigerum
3 references
stated in
The calanolides, a novel HIV-inhibitory class of coumarin derivatives from the tropical rainforest tree, Calophyllum lanigerum
stated in
The calanolides, a novel HIV-inhibitory class of coumarin derivatives from the tropical rainforest tree, Calophyllum lanigerum
stated in
The calanolides, a novel HIV-inhibitory class of coumarin derivatives from the tropical rainforest tree, Calophyllum lanigerum
Identifiers
InChI
InChI=1S/C24H28O6/c1-7-8-15-11-17(26)29-23-18(15)22-16(9-10-24(5,6)30-22)21-19(23)20(28-14(4)25)12(2)13(3)27-21/h9-13,20H,7-8H2,1-6H3/t12-,13-,20+/m1/s1
0 references
InChIKey
UVGXEFBQPYOCKP-IZDJOXEWSA-N
0 references
CAS Registry Number
142566-59-4
0 references
PubChem CID
454254
0 references
UniChem compound ID
628650
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90162085
1 reference
matched by identifier from
InChIKey
InChIKey
UVGXEFBQPYOCKP-IZDJOXEWSA-N
DSSTOX compound identifier
DTXCID9084576
0 references
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