CAS: 107745-73-3
Nombre: (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
SMILES:
CC(COCC1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(O2)C(C8O)O)COCC(C)O)COCC(C)O)COCC(C)O)COCC(C)O)COCC(C)O)COCC(C)O)O)O)OMolecular Processing
Molecular formula
C63H112O42
Molecular weight
1541.55
Exact mass
1540.6628
XLogP
-12.39
TPSA
618.66
H-bond donors
21
H-bond acceptors
42
Rotatable bonds
28
Heavy atoms
105
Rings
21
Aromatic rings
0
Saturated rings
21
Aliphatic rings
21
Stereo centers
42
Undefined stereo
42
Formal charge
0
Heteroatoms
42
Covalent units
1
Fraction Csp3
1
Molar refractivity
336.33
Supplementary Information
InChIKey: ODLHGICHYURWBS-LKONHMLTSA-N
Sinónimos
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 HPBHydroxypropylbetadexTHPBbeta-Cyclodextrin, 6A,6B,6C,6D,6E,6F,6G-heptakis-O-(2-hydroxypropyl)-Hydroxypropyl-beta-cyclodextrihydroxypropyl-beta cyclodextrinCHEMBL577294SCHEMBL29350553ODLHGICHYURWBS-LKONHMLTSA-NDTXSID401017375OH05393BRD-A01412266-001-01-0.beta.-Cyclodextrin, 6A,6B,6C,6D,6E,6F,6G-heptakis-O-(2-hydroxypropyl)-6A,6B,6C,6D,6E,6F,6G-Heptakis-O-(2-hydroxypropyl)-|A-cyclodextrin6A,6B,6C,6D,6E,6F,6G-Heptakis-O-(2-hydroxypropyl)-I(2)-cyclodextrinr
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