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(Q105127587)
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English
11-hydroxy-4,4,6a,6b,8a,11,12,14b-octamethyl-2,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-one
group of stereoisomers with the chemical formula C₃₀H₄₈O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
taraxastane / ursane triterpenoid
1 reference
inferred from
taraxastane / ursane triterpenoid
mass
440.365430776
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₈O₂
0 references
canonical SMILES
O=C1CCC2(C)C(CCC3(C)C2CC=C4C5C(C)C(O)(C)CCC5(C)CCC43C)C1(C)C
0 references
found in taxon
Salvia
1 reference
stated in
Rofficerone: A New Triterpenoid from Rosmarinus officinalis
Salvia officinalis
1 reference
stated in
Rofficerone: A New Triterpenoid from Rosmarinus officinalis
Identifiers
InChI
InChI=1S/C30H48O2/c1-19-24-20-9-10-22-27(5)13-12-23(31)25(2,3)21(27)11-14-29(22,7)28(20,6)17-15-26(24,4)16-18-30(19,8)32/h9,19,21-22,24,32H,10-18H2,1-8H3
0 references
InChIKey
JGOGEYGCWRVPQA-UHFFFAOYSA-N
0 references
PubChem CID
131752699
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JGOGEYGCWRVPQA-UHFFFAOYSA-N
UniChem compound ID
32020710
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0039642
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JGOGEYGCWRVPQA-UHFFFAOYSA-N
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