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(Q105348843)
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Chamaetexane C
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-ethenyl-10-hydroxy-1-(hydroxymethyl)-4b,8,8-trimethyl-4a,5,6,7,8a,9,10,10a-octahydro-4H-phenanthren-3-one
1 reference
based on heuristic
inferred from SMILES
mass
318.21949482
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₀O₃
0 references
canonical SMILES
O=C1C(C=C)=C(CO)C2C(O)CC3C(C)(C)CCCC3(C)C2C1
0 references
isomeric SMILES
C=CC1=C(CO)[C@@H]2[C@@H](O)C[C@H]3C(C)(C)CCC[C@]3(C)[C@H]2CC1=O
0 references
found in taxon
Chamaecrista greggii
1 reference
stated in
Cassanes and anthraquinones from Chamaecrista greggii
Identifiers
InChI
InChI=1S/C20H30O3/c1-5-12-13(11-21)18-14(9-15(12)22)20(4)8-6-7-19(2,3)17(20)10-16(18)23/h5,14,16-18,21,23H,1,6-11H2,2-4H3/t14-,16-,17-,18-,20+/m0/s1
0 references
InChIKey
YIHTZNWULXKAGH-ATCHWDNASA-N
0 references
PubChem CID
21762474
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
47658123
1 reference
stated in
UniChem
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