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(Q105353212)
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English
3a,6,6,9a,11a-pentamethyl-1-(1,5,6-trihydroxy-6-methylheptan-2-yl)-1H,2H,3H,4H,5H,5aH,7H,8H,9H,10H,11H-cyclopenta[a]phenanthrene-7,8,11-triol
group of stereoisomers with the chemical formula C₃₀H₅₂O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
lanostane triterpenoid
1 reference
inferred from
lanostane triterpenoid
mass
508.7314
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₅₂O₆
0 references
canonical SMILES
OCC(CCC(O)C(O)(C)C)C1CCC2(C3=C(CC(O)C12C)C4(C)CC(O)C(O)C(C)(C)C4CC3)C
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Identifiers
InChI
InChI=1S/C30H52O6/c1-26(2)22-10-9-19-20(28(22,5)15-21(32)25(26)35)14-24(34)30(7)18(12-13-29(19,30)6)17(16-31)8-11-23(33)27(3,4)36/h17-18,21-25,31-36H,8-16H2,1-7H3
0 references
InChIKey
YRXIDKUVBPMNRA-UHFFFAOYSA-N
0 references
PubChem CID
14506473
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YRXIDKUVBPMNRA-UHFFFAOYSA-N
UniChem compound ID
24464275
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0035853
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YRXIDKUVBPMNRA-UHFFFAOYSA-N
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