ALPHA-CYCLODEXTRIN, SULFATED SODIUM SALT HYDRATE

CAS No.
699020-02-5
CCD No.
CCD00949549
Formula
C36 H54 O48 S6 . 6 Na . H2 O
MolWeight
1603.13

Basic Information

Product Name: ALPHA-CYCLODEXTRIN, SULFATED SODIUM SALT HYDRATE
CAS: 699020-02-5
English Synonyms: ALPHA-CYCLODEXTRIN, SULFATED SODIUM SALT HYDRATE
MDL Number.: MFCD10567418
H bond acceptor: 48
H bond donor: 12
Smile: C([C@@H]1[C@@H]2[C@@H]([C@H]([C@H](O1)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](O[C@@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@H](O2)[C@@H]([C@H]7O)O)COS(=O)(=O)[O-])COS(=O)(=O)[O-])COS(=O)(=O)[O-])COS(=O)(=O)[O-])COS(=O)(=O)[O-])O)O)OS(=O)(=O)[O-].O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChi: InChI=1S/C36H60O48S6.6Na.H2O/c37-13-19(43)31-73-7(1-67-85(49,50)51)25(13)79-32-20(44)14(38)27(9(74-32)3-69-87(55,56)57)81-34-22(46)16(40)29(11(76-34)5-71-89(61,62)63)83-36-24(48)18(42)30(12(78-36)6-72-90(64,65)66)84-35-23(47)17(41)28(10(77-35)4-70-88(58,59)60)82-33-21(45)15(39)26(80-31)8(75-33)2-68-86(52,53)54;;;;;;;/h7-48H,1-6H2,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66);;;;;;;1H2/q;6*+1;/p-6/t7-,8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-;;;;;;;/m1......./s1
InChiKey: InChIKey=FNSMNNPNYHODTR-IJRUOVQTSA-H

Property

Melting Point: 190 DEG C (DEC)(LIT)
Comments: OPTICAL ACTIVITY: [ALPHA]23/D +78 DEG, C = 1 IN H2O
UNSPSC: 12352100
WGK: 3

Safety information

* If the product has intellectual property rights, a license granted is must or contact us.