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(Q82929212)
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English
9,19-Cyclolanosta-16,24-dien-3-ol
group of stereoisomers with the chemical formula C₃₀H₄₈O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
424.37051615599995
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₈O
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(C)=CCCC(C)C1=CCC2(C)C3CCC4C(C)(C)C(O)CCC45CC35CCC12C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(C)=CCC[C@@H](C)C1=CC[C@@]2(C)C3CC[C@H]4C(C)(C)[C@@H](O)CC[C@@]45C[C@@]35CC[C@]12C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C30H48O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h9,13,21,23-25,31H,8,10-12,14-19H2,1-7H3/t21-,23+,24?,25+,27-,28+,29-,30+/m1/s1
0 references
InChIKey
QQEBZBZJWRBJTK-KOPNNDSGSA-N
0 references
CAS Registry Number
28282-48-6
0 references
PubChem CID
472767
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
53396808
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID30950988
0 references
DSSTOX compound identifier
DTXCID901379124
0 references
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