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(Q105364974)
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English
[17-[1-(dimethylamino)ethyl]-3-(1,3-dioxoisoindol-2-yl)-2-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-yl] acetate
group of stereoisomers with the chemical formula C₃₃H₄₆N₂O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
pregnane steroid
1 reference
inferred from
pregnane steroid
isoindole alkaloid
1 reference
inferred from
isoindole alkaloid
mass
550.340672572
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₃H₄₆N₂O₅
0 references
canonical SMILES
O=C(OC1C(N2C(=O)C=3C=CC=CC3C2=O)C(O)CC4(C)C1CCC5C6CCC(C(N(C)C)C)C6(C)CCC54)C
0 references
found in taxon
Pachysandra procumbens
1 reference
stated in
Activity-guided isolation of steroidal alkaloid antiestrogen-binding site inhibitors from Pachysandra procumbens
Identifiers
InChI
InChI=1S/C33H46N2O5/c1-18(34(5)6)23-13-14-24-22-11-12-26-29(40-19(2)36)28(35-30(38)20-9-7-8-10-21(20)31(35)39)27(37)17-33(26,4)25(22)15-16-32(23,24)3/h7-10,18,22-29,37H,11-17H2,1-6H3
0 references
InChIKey
YUUHBLRWEZLNID-UHFFFAOYSA-N
0 references
PubChem CID
75051848
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YUUHBLRWEZLNID-UHFFFAOYSA-N
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