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(Q104399613)
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English
(2,9-Diacetyloxy-7-ethenyl-3,8a-dihydroxy-1,1,4a,7-tetramethyl-5,8-dioxo-2,3,4,4b,6,9,10,10a-octahydrophenanthren-4-yl) benzoate
group of stereoisomers with the chemical formula C₃₁H₃₈O₁₀
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Statements
instance of
group of stereoisomers
0 references
subclass of
pimarane diterpenoid
1 reference
inferred from
pimarane diterpenoid
mass
570.246497416
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₁H₃₈O₁₀
0 references
canonical SMILES
O=C(OC1C(O)C(OC(=O)C)C(C)(C)C2CC(OC(=O)C)C3(O)C(=O)C(C=C)(C)CC(=O)C3C12C)C=4C=CC=CC4
0 references
found in taxon
Orthosiphon grandiflorus
2 references
stated in
Highly-Oxygenated Isopimarane-Type Diterpenes from Orthosiphon stamineus of Indonesia and Their Nitric Oxide Inhibitory Activity.
stated in
Inhibition of NO production by highly-oxygenated diterpenes of Orthosiphon stamineus and their structure-activity relationship
Orthosiphon aristatus
2 references
stated in
Inhibition of NO production by highly-oxygenated diterpenes of Orthosiphon stamineus and their structure-activity relationship
stated in
Highly-Oxygenated Isopimarane-Type Diterpenes from Orthosiphon stamineus of Indonesia and Their Nitric Oxide Inhibitory Activity.
Identifiers
InChI
InChI=1S/C31H38O10/c1-8-29(6)15-19(34)23-30(7)20(14-21(39-16(2)32)31(23,38)27(29)37)28(4,5)24(40-17(3)33)22(35)25(30)41-26(36)18-12-10-9-11-13-18/h8-13,20-25,35,38H,1,14-15H2,2-7H3
0 references
InChIKey
XLRIHDFQQHCYGO-UHFFFAOYSA-N
0 references
PubChem CID
162842454
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XLRIHDFQQHCYGO-UHFFFAOYSA-N
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