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(Q82957465)
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English
CID 6453550
group of stereoisomers with the chemical formula C₃₀H₄₈O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
488.3501746359999
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₈O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC1CC2OC3(OC2C(C)(C)O)C1C1(C)CCC24CC25CCC(O)C(C)(C)C5CCC4C1(C)C3O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@@H]1C[C@H]2OC3(O[C@H]2C(C)(C)O)C1[C@@]1(C)CCC24CC25CC[C@H](O)C(C)(C)C5CC[C@H]4[C@]1(C)[C@@H]3O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C30H48O5/c1-16-14-17-22(25(4,5)33)35-30(34-17)21(16)26(6)12-13-29-15-28(29)11-10-20(31)24(2,3)18(28)8-9-19(29)27(26,7)23(30)32/h16-23,31-33H,8-15H2,1-7H3/t16-,17-,18?,19+,20+,21?,22-,23+,26-,27-,28?,29?,30?/m1/s1
0 references
InChIKey
CNBHUROFMYCHGI-ONYLVBOWSA-N
0 references
CAS Registry Number
57943-48-3
0 references
PubChem CID
6453550
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
61938720
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50973518
0 references
DSSTOX compound identifier
DTXCID301400969
0 references
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