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Caesaldekarin b
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
cassane diterpenoid
0 references
mass
318.21949482
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₀O₃
0 references
canonical SMILES
OC1CC2C(C=3C=COC3CC2C4(C)CCCC(C)(C)C14O)C
0 references
isomeric SMILES
C[C@H]1c2ccoc2C[C@H]2[C@H]1C[C@@H](O)[C@@]1(O)C(C)(C)CCC[C@]21C
0 references
found in taxon
Caesalpinia major
3 references
stated in
Cassane diterpenoid from Caesalpinia major
stated in
Indonesian Medicinal Plants. XI. Chemical Structures of Caesaldekarins a and b, Two New Cassane-Type Furanoditerpenes from the Roots of Caesalpinia major (Fabaceae).
stated in
Chemical Study of Indonesian Medicinal Plants
Identifiers
InChI
InChI=1S/C20H30O3/c1-12-13-6-9-23-16(13)11-15-14(12)10-17(21)20(22)18(2,3)7-5-8-19(15,20)4/h6,9,12,14-15,17,21-22H,5,7-8,10-11H2,1-4H3/t12-,14-,15-,17+,19+,20+/m0/s1
0 references
InChIKey
VVTANXRWACJOPI-GMLOIOGESA-N
0 references
PubChem CID
10403613
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VVTANXRWACJOPI-GMLOIOGESA-N
UniChem compound ID
32034275
1 reference
stated in
UniChem
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