Adenosine 5′-(hexahydrogen pentaphosphate), P′′′′→5′-ester with adenosine, lithium salt (1:3)
CAS Registry Number®
75522-97-3
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CAS Name
Adenosine 5′-(hexahydrogen pentaphosphate), P′′′′→5′-ester with adenosine, lithium salt (1:3)Molecular Formula
C20H29N10O22P5.3LiCite this Page
Adenosine 5′-(hexahydrogen pentaphosphate), P′′′′→5′-ester with adenosine, lithium salt (1:3). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=75522-97-3 (retrieved ) (CAS RN: 75522-97-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H29N10O22P5.3Li/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(47-19)1-45-53(35,36)49-55(39,40)51-57(43,44)52-56(41,42)50-54(37,38)46-2-8-12(32)14(34)20(48-8)30-6-28-10-16(22)24-4-26-18(10)30;;;/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42)(H,43,44)(H2,21,23,25)(H2,22,24,26);;;/t7-,8-,11-,12-,13-,14-,19-,20-;;;/m1.../s1
InChIKey
InChIKey=OHHGVQISHFUWEX-JJCYRVQFSA-N
SMILES
O[C@H]1[C@H](N2C=3C(N=C2)=C(N)N=CN3)O[C@H](COP(OP(OP(OP(OP(OC[C@H]4O[C@H]([C@H](O)[C@@H]4O)N5C=6C(N=C5)=C(N)N=CN6)(=O)O)(=O)O)(=O)O)(=O)O)(=O)O)[C@H]1O.[Li]
Canonical SMILES
[Li].O=P(O)(OCC1OC(N2C=NC=3C(=NC=NC32)N)C(O)C1O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OCC4OC(N5C=NC=6C(=NC=NC65)N)C(O)C4O
Other Names for this Substance
- Adenosine 5′-(hexahydrogen pentaphosphate), P′′′′→5′-ester with adenosine, lithium salt (1:3)
- Adenosine 5′-(hexahydrogen pentaphosphate), P′′′′→5′-ester with adenosine, trilithium salt
- Adenosine 5′-(hexahydrogen pentaphosphate) P′′′′→5′-ester with adenosine, lithium salt (1:3)
