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(Q106956353)
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English
17-ethyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
288.5113
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₆
1 reference
PubChem CID
12547
retrieved
23 May 2021
canonical SMILES
CCC1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C
1 reference
PubChem CID
12547
retrieved
23 May 2021
melting point
83.5
degree Celsius
1 reference
stated in
BradleyDoublePlusGoodMeltingPointDataset
Identifiers
InChI
InChI=1S/C21H36/c1-4-15-9-11-18-17-10-8-16-7-5-6-13-20(16,2)19(17)12-14-21(15,18)3/h15-19H,4-14H2,1-3H3
1 reference
PubChem CID
12547
retrieved
23 May 2021
InChIKey
JWMFYGXQPXQEEM-UHFFFAOYSA-N
1 reference
PubChem CID
12547
retrieved
23 May 2021
PubChem CID
12547
1 reference
retrieved
23 May 2021
ChEBI ID
61313
mapping relation type
exact match
1 reference
stated in
ChEBI release 2022-06-13
UniChem compound ID
24125654
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0247017
1 reference
based on heuristic
inferred from InChIKey
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