Bevirimat dimeglumine
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(3-carboxy-3-methylbutanoyl)oxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid;bis((2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol)
Molecular Identity
Bevirimat dimeglumine
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-(3-carboxy-3-methylbutanoyl)oxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid;bis((2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol)
PubChem CID: 11400413
2D Structure
Properties
C50H90N2O16
Molecular Formula
975.30
Molecular Weight
g/mol
974.6290
Exact Mass
Da
327
TPSA
May have limited oral absorption
14
H-Bond Donors
18
H-Bond Acceptors
1300
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Bevirimat dimegluminePA-457 di-NMGDSB*2NMGPA-457NO6DDV91W1MBevirimat dimeglumine saltPA103001PA-103001-04823821-85-8RefChem:119576BIS(1-DEOXY-1-(METHYLAMINO)-D-GLUCITOL) 3BETA-(3-CARBOXYLATO-3-METHYLBUTANOYLOXY)LUP-20(29)-EN-28-OATELUP-20(29)-EN-28-OIC ACID, 3-(3-CARBOXY-3-METHYL-1-OXOBUTOXY)-, (3BETA)-, COMPD. WITH 1-DEOXY-1-(METHYLAMINO)-D-GLUCITOL (1:2)Bevirimat dimeglumine [USAN]UNII-O6DDV91W1MMPC-4326
Data from PubChem (NCBI)
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Trials and conditions connected to Bevirimat dimeglumine
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