(Q105364974)

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

1 reference

1 reference

550.340672572 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₆N₂O₅

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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

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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

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InChIKey

YUUHBLRWEZLNID-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YUUHBLRWEZLNID-UHFFFAOYSA-N

(Q105364974)

[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

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