2 Hydroxypropyl beta cyclodextrin
(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,25,30,35-heptakis(2-hydroxypropoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol
Molecular Identity
2 Hydroxypropyl beta cyclodextrin
(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,25,30,35-heptakis(2-hydroxypropoxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol
PubChem CID: 14049689
2D Structure
Properties
C63H112O42
Molecular Formula
1541.50
Molecular Weight
g/mol
1540.6628
Exact Mass
Da
-13
XLogP
Drug-like (Lipinski: < 5)
619
TPSA
May have limited oral absorption
21
H-Bond Donors
42
H-Bond Acceptors
2010
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
2 Hydroxypropyl beta cyclodextrinHP-beta-CDHPbetaCDBetadex, Hydroxypropylbeta Hydroxypropylcyclodextrinbeta-Hydroxypropylcyclodextrin2 hydroxypropyl-beta-cyclodextrinRefChem:909949DTXSID208942812-Hydroxypropyl-Beta-CyclodextrinHydroxypropyl-Beta-Cyclodextrin107745-73-3Trappsol Cyclo6A,6B,6C,6D,6E,6F,6G-Heptakis-O-(2-hydroxypropyl)-beta-cyclodextrinTrappsol HPB
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 2 Hydroxypropyl beta cyclodextrin
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