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(Q105265535)
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English
(3aR,5aR,9R,10aR)-9-hydroxy-8-(hydroxymethyl)-3a,5a-dimethyl-1-propan-2-yl-2,4,5,9,10,10a-hexahydrocyclohepta[e]indene-3,6-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
cyathane diterpenoid
0 references
mass
332.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₄
0 references
canonical SMILES
O=C1C=C(CO)C(O)CC2C3=C(CC(=O)C3(C)CCC12C)C(C)C
0 references
isomeric SMILES
CC(C)C1=C2[C@H]3C[C@@H](O)C(CO)=CC(=O)[C@]3(C)CC[C@@]2(C)C(=O)C1
0 references
found in taxon
Cyathus africanus
1 reference
stated in
Metabolites of bird's nest fungi. Part 9. Diterpenoid metabolites of Cyathusafricanus Brodie
Identifiers
InChI
InChI=1S/C20H28O4/c1-11(2)13-8-17(24)20(4)6-5-19(3)14(18(13)20)9-15(22)12(10-21)7-16(19)23/h7,11,14-15,21-22H,5-6,8-10H2,1-4H3/t14-,15-,19-,20+/m1/s1
0 references
InChIKey
TVTDDLXYCKQWON-IONDEXAJSA-N
0 references
PubChem CID
163106089
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
TVTDDLXYCKQWON-IONDEXAJSA-N
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