UCSF

ZINC03927200

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2005 27 No

Popular Name: Drospirenone Drospirenone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 67392-87-4 , [67392-87-4]

Other Names:

(6R,7R,8R,9S,10R,13S,14S,15S,16S,17S)-1,3',4',6,6a,7,8,9,10,11,12,13,14,15,15a,16-Hexadecahydro-10,13-dimethylspiro-(17H-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthrene-17,2'(5'H)-furan)-3,5'(2H)-dione

(6R,7R,8R,9S,10R,13S,14S,15S,16S,17S)-1,3',4',6,6a,7,8,9,10,11,12,13,14,15,15a,16-Hexadecahydro-10,13-dimethylspiro-(17H-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthrene-17,2'(5'H)-furan)-3,5'(2H)-dione; 1,2-Dihydrospirorenone; 1,2-dihydro-spirorenone; 17

renone

1, 2-Dihydrospirorenone

1,2-dihydro-spirorenone

1,2-Dihydrospirorenone

1,2-Dihydrospirorenone; 6beta,7beta;15beta,16beta-Dimethylene-3-oxo-17alpha-pregn-4-ene-21,17-carbolactone; Dehydrospirorenone

15,16]-17alpha-pregn-4-ene-21,17-carbolactone

15-beta,16-beta-Dimethylene-3-oxo-17-alpha-pregn-4-ene-21,17-carbolactone

15beta,16beta-Dimethylene-3-oxo-17alpha-pregn-4-ene-21,17-carbolactone

17-Hydroxy-6beta,7beta:15beta,16beta-dimethylene-3-oxo-17alpha-pregn-4-ene-21-carboxylic acid, gamma-lactone

19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, (17alpha)-, mixt. with (2'S,6R,7R,8R,9S,10R,13S,14S,15S,16S)-3',4',6,7,8,9,10,11,12,13,14,15,16,20,21-hexadecahydro-10,13-dimethylspiro(17H-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthrene-17,2'(5'H)-furan)-3

3-oxo-6alpha,7alpha,15alpha,16alpha-tetrahydro-7'H,16'H-dicyclopropa[6,7

6-beta,7-beta

67392-87-4

67392-87-4; D03917; Drospirenone (JAN/USP/INN)

6beta,7beta

6beta,7beta,15beta,16beta-dimethylen-3-oxo-17alpha-pregn-4-en-21,17-carbolacton

6beta,7beta,15beta,16beta-dimethylene-3-oxo-17alpha-pregn-4-ene-21,17 carbolactone

6β,7β,15β,16β-dimethylene-3-oxo-17α-pregn-4-ene-21,17 carbolactone

6β,7β,15β,16β-dimethylene-3-oxo-17α-pregn-4-ene-21,17 carbolactone;Drospirenona [inn-spanish];Drospirenonum [inn-latin];DRSP

AC1L2AMM

Angeliq

Angeliq, Drospirenone

ANGELIQ; DROSPIRENONE; ESTRADIOL; LS-187936

BAN

BRN 4765500

C035144

C24H30O3

CCRIS 6523

CHEBI:50838

CHEMBL1509

CID68873

D03917

DAP001206

DB01395

Dehydrospirorenone

Dihydrospirorenone

Drospirenona

Drospirenona [inn-spanish]

drospirenona; drospirenone; drospirenonum

Drospirenone (BAN

Drospirenone (FDA

Drospirenone (JAN/USAN/INN)

Drospirenone [INN]

Drospirenonum

Drospirenonum [inn-latin]

DRSP

EINECS 266-679-2

FDA

INN

LS-146115

MFCD00867350

Not available

S1377_Selleck

Safyral

SH-470

Spiro(17H-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthrene-17,2'(5'H)-furan)-3,5'(2H)-dione, 1,3',4',6,7,8,9,10,11,12,13,14,15,16,20,21-hexadecahydro-10,13-dimethyl-, (6R-(6alpha,7alpha,8beta,9alpha,10beta,13beta,14alpha,15alpha,16alpha,17beta

Spiro(17H-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthrene-17,2'(5'H)-furan)-3,5'(2H)-dione, 1,3',4',6,7,8,9,10,11,12,13,14,15,16,20,21-hexadecahydro-10,13-dimethyl-, (6R-(6alpha,7alpha,8beta,9alpha,10beta,13beta,14alpha,15alpha,16alpha,17beta))-

UNII-N295J34A25

USAN)

Yasmin

Yaz

ZINC03927200

ZK 30595

ZK-30595

ZK30595

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) 3.66 2.46 -13.45 0 3 0 43 366.501 0 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.25e-03 g/l DrugBank-approved
Purity 99.0% APIChem
PUBCHEM_PATENT_ID EP0735882A1; EP0735883A1; EP0772441A1; EP0814785A1; EP0854705A2; EP0868188A2; EP0874627A1; EP0917466A1; EP0918791A1; EP0921804A1; EP0956024A1; EP1023055A1; EP1051179A2; US5583129; US5789442; US5824667; US5858405; US5888543; US5897539; US5922349; US6043234 IBM Patent Data
Patent Database Links EP1535618; EP1550447; EP1598069; EP1611892; EP1625849; EP1632237; EP1738752; EP1900359; EP1902711; EP1958628; EP1980242; EP1982719; US2007189977; US2007196323; US2007196452; US2007196453; US2007197488; US2007207945; US2007248658; WO2007106264; WO200713180 ChEBI
Target Estrogen/progestogen Receptor Selleck Chemicals

Activity (Go SEA)

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