β-Alanine, N-[(3′,6′-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-5-yl)carbonyl]-, 3′-ester with 2′-deoxy-5′-O-phosphonocytidylyl-(3′→5′)-adenosine (ACI),1049782-88-8-Amadis Chemical

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[CAS No.1049782-88-8] A1254614 β-Alanine, N-[(3′,6′-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-5-yl)carbonyl]-, 3′-ester with 2′-deoxy-5′-O-phosphonocytidylyl-(3′→5′)-adenosine (ACI) 97%

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Catalog No.: A1254614

Cas No.: 1049782-88-8

Molecular Formula: C₄₃H₄₁N₉O₂₀P₂

Molecular Weight: 1,065.78

MDL NO:

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Product Details [1049782-88-8]

Synonyms: β-Alanine, N-[(3′,6′-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-5-yl)carbonyl]-, 3′-ester with 2′-deoxy-5′-O-phosphonocytidylyl-(3′→5′)-adenosine (ACI)

Appearance:

Storage: Store in 2-8°C for long term (months)

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Melting point:

Flash point:

Pubchem ID:

Smiles: O=C1OC2(C=3C1=CC(C(NCCC(O[C@@H]4[C@@H](COP(O[C@@H]5[C@@H](COP(=O)(O)O)O[C@H](C5)N6C(=O)N=C(N)C=C6)(=O)O)O[C@H]([C@@H]4O)N7C=8C(N=C7)=C(N)N=CN8)=O)=O)=CC3)C=9C(OC=%10C2=CC=C(O)C%10)=CC(O)=CC9

InchiKey: RXYYMJUEDTXLBM-LFUVJYHGSA-N

Inchi: InChI=1S/C43H41N9O20P2/c44-31-8-10-51(42(59)50-31)32-14-28(29(68-32)15-65-73(60,61)62)72-74(63,64)66-16-30-36(35(56)40(69-30)52-18-49-34-37(45)47-17-48-38(34)52)70-33(55)7-9-46-39(57)19-1-4-23-22(11-19)41(58)71-43(23)24-5-2-20(53)12-26(24)67-27-13-21(54)3-6-25(27)43/h1-6,8,10-13,17-18,28-30,32,35-36,40,53-54,56H,7,9,14-16H2,(H,46,57)(H,63,64)(H2,44,50,59)(H2,45,47,48)(H2,60,61,62)/t28-,29+,30+,32+,35+,36+,40+/m0/s1

Safety [1049782-88-8]

GHS Pictogram:

Signal Word: Warning

Class:

Precautionary Statements: P261;P280;P305+P351+P338

UN No.:

Hazard Statements: H302;H315;H319;H332;H335

Packing Group:

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