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(Q110187151)
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English
Cordylane D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(4S,11bR)-4-(hydroxymethyl)-11b-methyl-7-methylidene-2,3,4a,5,6,6a,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
330.183109312
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(4S,4aS,6aS,11aS,11bR)-4-(hydroxymethyl)-11b-methyl-7-methylidene-2,3,4a,5,6,6a,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-4-carboxylic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₆O₄
0 references
canonical SMILES
O=C(O)C1(CO)CCCC2(C)C3CC=4OC=CC4C(=C)C3CCC12
0 references
isomeric SMILES
C=C1c2ccoc2C[C@H]2[C@H]1CC[C@H]1[C@@](CO)(C(=O)O)CCC[C@]21C
0 references
found in taxon
Cordyla madagascariensis
1 reference
stated in
Antiproliferative cassane diterpenoids of Cordyla madagascariensis ssp. madagascariensis from the Madagascar rainforest
Identifiers
InChI
InChI=1S/C20H26O4/c1-12-13-4-5-17-19(2,7-3-8-20(17,11-21)18(22)23)15(13)10-16-14(12)6-9-24-16/h6,9,13,15,17,21H,1,3-5,7-8,10-11H2,2H3,(H,22,23)/t13-,15-,17+,19+,20+/m0/s1
0 references
InChIKey
QIHOKLBFXIBNNW-YFALUVIFSA-N
0 references
PubChem CID
24770366
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
77492
1 reference
stated in
UniChem
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