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(Q105329060)
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English
CID 21325844
group of stereoisomers with the chemical formula C₃₀H₄₈O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
oleanane triterpenoid
1 reference
inferred from
oleanane triterpenoid
mass
488.350174636
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₈O₅
0 references
canonical SMILES
O=C(O)C12CCC3(C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C2C(O)C(C)(C)CC1)C
0 references
found in taxon
Picrorhiza kurroa
1 reference
stated in
Cyclooxygenase-2 enzyme inhibitory triterpenoids from Picrorhiza kurroa seeds
Identifiers
InChI
InChI=1S/C30H48O5/c1-25(2)12-14-30(24(34)35)15-13-28(6)17(21(30)23(25)33)8-9-20-27(5)16-18(31)22(32)26(3,4)19(27)10-11-29(20,28)7/h8,18-23,31-33H,9-16H2,1-7H3,(H,34,35)
0 references
InChIKey
XJMYUPJDAFKICJ-UHFFFAOYSA-N
0 references
PubChem CID
21325844
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XJMYUPJDAFKICJ-UHFFFAOYSA-N
ChEBI ID
181308
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C30H48O5/c1-25(2)12-14-30(24(34)35)15-13-28(6)17(21(30)23(25)33)8-9-20-27(5)16-18(31)22(32)26(3,4)19(27)10-11-29(20,28)7/h8,18-23,31-33H,9-16H2,1-7H3,(H,34,35)
UniChem compound ID
29342282
1 reference
stated in
UniChem
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