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(Q104196711)
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English
9,9-Bis(hydroxymethyl)-1,2,4a,6a,6b,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-1,10,11-triol
group of stereoisomers with the chemical formula C₃₀H₅₀O₅
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Statements
instance of
group of stereoisomers
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subclass of
taraxastane / ursane triterpenoid
1 reference
inferred from
taraxastane / ursane triterpenoid
mass
490.36582469999985
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₅₀O₅
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canonical SMILES
OCC1(CO)C(O)C(O)CC2(C)C3CC=C4C5C(O)(C)C(C)CCC5(C)CCC4(C)C3(C)CCC21
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Identifiers
InChI
InChI=1S/C30H50O5/c1-18-9-11-25(2)13-14-27(4)19(23(25)29(18,6)35)7-8-21-26(3)15-20(33)24(34)30(16-31,17-32)22(26)10-12-28(21,27)5/h7,18,20-24,31-35H,8-17H2,1-6H3
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InChIKey
RLCUKXXGZYXKAF-UHFFFAOYSA-N
0 references
PubChem CID
73819199
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RLCUKXXGZYXKAF-UHFFFAOYSA-N
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