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(Q105159550)
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English
CID 2432
group of stereoisomers with the chemical formula C₅₀H₇₀O₁₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
894.47655692
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅₀H₇₀O₁₄
0 references
canonical SMILES
O=CC(=C)CC1OC2CC3OC4C=CCC5(OC6CC7OC8C(OC9CC%10(OC%11C(=CC(=O)OC%11CC%10OC9CC8C)C)C)CCC7(OC6(C)CC5OC4CC3OC2(C)C(O)C1)C)C
0 references
Identifiers
InChI
InChI=1S/C50H70O14/c1-25(24-51)14-28-17-37(52)50(8)41(54-28)19-33-34(61-50)18-32-29(55-33)10-9-12-46(4)42(58-32)23-49(7)40(62-46)21-39-47(5,64-49)13-11-30-44(60-39)26(2)15-31-36(56-30)22-48(6)38(57-31)20-35-45(63-48)27(3)16-43(53)59-35/h9-10,16,24,26,28-42,44-45,52H,1,11-15,17-23H2,2-8H3
0 references
InChIKey
LYTCVQQGCSNFJU-UHFFFAOYSA-N
0 references
PubChem CID
2432
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LYTCVQQGCSNFJU-UHFFFAOYSA-N
UniChem compound ID
47151602
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0248191
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LYTCVQQGCSNFJU-UHFFFAOYSA-N
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