Molecules/Enstilar

Enstilar

[2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate;trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-5-cyclopropyl-5-hydroxypent-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol

C55H77FO10917.20 g/molCID 9832804

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Molecular Identity

Enstilar

PubChem CID: 9832804

2D Structure

Properties

C₅₅H₇₇FO₁₀

Molecular Formula

917.20

Molecular Weight

g/mol

916.5501

Exact Mass

168

TPSA

May have limited oral absorption

H-Bond Donors

H-Bond Acceptors

1790

Complexity

SMILES

Canonical SMILES

SMILES: CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)C)OC(=O)CC.CC(C=CC(C1CC1)O)C2CCC3C2(CCCC3=CC=C4CC(CC(C4=C)O)O)C

Isomeric SMILES

SMILES: CCC(=O)OCC(=O)[C@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)OC(=O)CC.C[C@H](/C=C/[C@H](C1CC1)O)[C@H]2CC[C@@H]\3[C@@]2(CCC/C3=C\C=C/4\C[C@H](C[C@@H](C4=C)O)O)C

Synonyms(12)

Enstilar485805-18-3DaivobetDovobetTaclonex scalpLEO 80185Calcipotriol/betamethasone dipropionateBetamethasone dipropionate and calcipotrieneCalcipotriene and betamethasone dipropionateBetamethasone dipropionate-calcipotriene mixt.SCHEMBL18863209Pregna-1,4-diene-3,20-dione, 9-fluoro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)-, (11beta,16beta)-, mixt. with (1alpha,3beta,5Z,7E,22E,24S)-24-cyclopropyl-9,10-secochola- 5,7,10(19),22-tetraene-1,3,24-triol

Data from PubChem (NCBI)

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Molecular Structure

Enstilar

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Source: PubChem

Drug Network

Trials and conditions connected to Enstilar

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