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5'-Guanylic acid,monoanhydride with phosphorothioic acid, trilithium salt (9CI)

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Name

5'-Guanylic acid,monoanhydride with phosphorothioic acid, trilithium salt (9CI)

EINECS 308-328-9
CAS No. 97952-36-8 Density N/A
PSA 295.70000 LogP 0.21010
Solubility N/A Melting Point N/A
Formula C10H15N5O10P2S.3Li Boiling Point N/A
Molecular Weight 480.07 Flash Point N/A
Transport Information N/A Appearance solid
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 97952-36-8 (GUANOSINE 5'-O-(2-THIODIPHOSPHATE) TRILITHIUM SALT) Hazard Symbols IrritantXi
Synonyms

GDP-BETA-S TRILITHIUM SALT;GDP-BETA-S 3LI;GDP-BETA-S TRILITHIUM;GDP-BETA-S-LI3;GUANOSINE 5-[BETA-THIO]DIPHOSPHATE TRILITHIUM SALT;GUANOSINE-5-O-(2-THIODIPHOSPHATE) TRILITHIUM;GUANOSINE-5-O-(2-THIODIPHOSPHORIC ACID), TRILITHIUM;GUANOSINE 5-O-(2-THIODIPHOSPHATE) TRILITHIUM SALT

 

5'-Guanylic acid,monoanhydride with phosphorothioic acid, trilithium salt (9CI) Specification

The IUPAC name of 5'-Guanylic acid,monoanhydride with phosphorothioic acid, trilithium salt (9CI) is trilithium [5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dioxidophosphinothioyl phosphate. With the CAS registry number 97952-36-8, it is also named as Guanosine 5'-o-(2-thiodiphosphate) trilithium salt. It is solid which is stable under normal temperature and pressure. Additioanlly, this chemical should be sealed in the container and stored in the cool and dry place with the temperature of -20 °C.

The other characteristics of 5'-Guanylic acid,monoanhydride with phosphorothioic acid, trilithium salt (9CI) can be summarized as: (1)H-Bond Donor: 4; (2)H-Bond Acceptor: 13; (3)Rotatable Bond Count: 6; (4)Tautomer Count: 9; (5)Exact Mass: 477.026022; (6)MonoIsotopic Mass: 477.026022; (7)Topological Polar Surface Area: 272; (8)Heavy Atom Count: 31; (9)Formal Charge: 0; (10)Complexity: 757; (11)Undefined Atom StereoCenter Count: 4; (12)Defined Bond StereoCenter Count: 0; (13)Undefined Bond StereoCenter Count: 0; (14)Covalently-Bonded Unit Count: 4.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing.

People can use the following data to convert to the molecule structure. 
1. Canonical SMILES: [Li+].[Li+].[Li+].C1=NC2=C(N1C3C(C(C(O3)COP(=O)([O-])OP(=S)([O-])[O-])O)O)NC(=NC2=O)N
2. InChI: InChI=1S/C10H15N5O10P2S.3Li/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(24-9)1-23-26(19,20)25-27(21,22)28;;;/h2-3,5-6,9,16-17H,1H2,(H,19,20)(H2,21,22,28)(H3,11,13,14,18);;;/q;3*+1/p-3
3. InChIKey: LMCWQGPJYZRMKU-UHFFFAOYSA-K

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