UCSF

ZINC03875993

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 27 No

CAS Numbers: 152-43-2 , [152-43-2]

Other Names:

(8R,9S,13S,14S,17R)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol

estr-

152-43-2

152-43-2; C07619; Quinestrol

152-43-2; D00576; Estrovis (TN); Quinestrol (USAN/INN)

17-alpha-Ethinylestradiol 3-cyclopentyl ether

17-alpha-Ethinylestradiol 3-cyclopentyl ether; 17alpha-Ethynylestradiol 3-cyclopentyl ether; Estradiol-17-beta 3-cyclopentyl ether; Quinestrol

17-alpha-Ethinylestradiol 3-cyclopentyl ether; 19-Nor-17-alpha-pregna-1,3,5(10)-trien-20-yn-17-ol, 3-(cyclopentyloxy)-; 19-Norpregna-1,3,5(10)-trien-20-yn-17-ol, 3-(cyclopentyloxy)-, (17alpha)-; 3-(Cyclopentyloxy)-19-nor-17-alpha-pregna-1,3,5(10)-trien-20

17-alpha-Ethinylestradiol 3-cyclopentyl ether;17alpha-Ethynylestradiol 3-cyclopentyl ether;Estradiol-17-beta 3-cyclopentyl ether;Quinestrolo [dcit];Quinestrolum [inn-latin]

17?-Ethynylestradiol 3-cyclopentyl ether

17ALPHA-ETHYLNYL-1,3,5[10]ESTRATRIENE-3,17BETA-DIOL 3-CYCLOPENTYL ETHER

17alpha-Ethynyl-1,3,5(10)-estratriene-3,17beta-diol 3-cyclopentyl ether

17alpha-Ethynylestradiol 3-cyclopentyl ether

19-Nor-17-alpha-pregna-1,3,5(10)-trien-20-yn-17-ol, 3-(cyclopentyloxy)-

19-Norpregna-1,3,5(10)-trien-20-yn-17-ol, 3-(cyclopentyloxy)-, (17alpha)-

3-(cyclopentyloxy)-17beta-ethynylestra-1,3,5(10)-trien-17-ol

3-(Cyclopentyloxy)-19-nor-17-alpha-pregna-1,3,5(10)-trien-20-yn-17-ol

3-(Cyclopentyloxy)-19-nor-17alpha-pregna-1,3,5(10)-trien-20-yn-17-ol

3-Cyclopentyloxy-17alpha-ethynylestra-1,3,5(10)-trien-17beta-ol

3-o-cyclopentyl-17alpha-ethinyl-estra-1,3,5(10)-triene-3,17beta-diol

AC1L1S77

BAN

C07619

C25H32O2

CHEBI:8716

CHEMBL1201165

CID9046

D00576

DAP001016

DB04575

E7887_SIGMA

EECPE

EINECS 205-803-1

Eston

Estradiol-17-beta 3-cyclopentyl ether

Estrovis

Estrovis (TN)

Estrovis 4000

Estrovister

Ethinyl Estradiol 3-Cyclopentyl Ether

FDA

INN

LMST02010037

LS-97370

MFCD00079189

MLS000069756

MLS001077287

MolPort-003-941-325

NCGC00166146-01

Plestrovis

QA-8253

Qui-lea

Quilea

Quinestrol (BAN

Quinestrol (FDA

Quinestrol (USAN/INN)

Quinestrol [USAN:INN:BAN]

quinestrol; quinestrolum

Quinestrolo

Quinestrolo [dcit]

Quinestrolum

Quinestrolum [inn-latin]

SMR000058815

UNII-JR0N7XD5GZ

USAN

USAN)

USP

USP)

W 3566

W-3566

ZINC03875993

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.60 10.92 -5.25 1 2 0 29 364.529 2

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.57e-03 g/l DrugBank-approved
Therapy estrogen SMDC Pharmakon

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )