Synonyms:
α-3′-Thymidylic acid, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-P-(4-chlorophenyl)-2′-deoxy-α-cytidylyl-(3′→5′)-N-benzoyl-P-(4-chlorophenyl)-2′-deoxy-α-cytidylyl-(3′→5′)-P-(4-chlorophenyl)-α-thymidylyl-(3′→5′)-, 4-chlorophenyl 2-cyanoethyl ester (9CI)
Appearance:
Storage:
Store in 2-8°C for long term (months)
Boiling point:
Melting point:
Flash point:
Smiles:
C(OC[C@@H]1[C@@H](OP(OC[C@@H]2[C@@H](OP(OC[C@@H]3[C@@H](OP(OC[C@@H]4[C@@H](OP(OC5=CC=C(Cl)C=C5)(OCCC#N)=O)C[C@H](O4)N6C(=O)NC(=O)C(C)=C6)(OC7=CC=C(Cl)C=C7)=O)C[C@H](O3)N8C(=O)NC(=O)C(C)=C8)(OC9=CC=C(Cl)C=C9)=O)C[C@H](O2)N%10C(=O)N=C(NC(=O)C%11=CC=CC=C%11)C=C%10)(OC%12=CC=C(Cl)C=C%12)=O)C[C@H](O1)N%13C(=O)N=C(NC(=O)C%14=CC=CC=C%14)C=C%13)(C%15=CC=C(OC)C=C%15)(C%16=CC=C(OC)C=C%16)C%17=CC=CC=C%17
InchiKey:
RYJYMQGZLNAOIC-MSWZSYMDSA-N
Inchi:
InChI=1S/C100H93Cl4N11O31P4/c1-61-55-114(98(122)110-92(61)116)90-53-80(143-147(124,131-50-14-47-105)139-74-37-25-68(101)26-38-74)84(137-90)59-133-150(127,142-77-43-31-71(104)32-44-77)146-81-54-91(115-56-62(2)93(117)111-99(115)123)138-85(81)60-134-149(126,141-76-41-29-70(103)30-42-76)145-79-52-89(113-49-46-87(109-97(113)121)107-95(119)64-17-10-6-11-18-64)136-83(79)58-132-148(125,140-75-39-27-69(102)28-40-75)144-78-51-88(112-48-45-86(108-96(112)120)106-94(118)63-15-8-5-9-16-63)135-82(78)57-130-100(65-19-12-7-13-20-65,66-21-33-72(128-3)34-22-66)67-23-35-73(129-4)36-24-67/h5-13,15-46,48-49,55-56,78-85,88-91H,14,50-54,57-60H2,1-4H3,(H,110,116,122)(H,111,117,123)(H,106,108,118,120)(H,107,109,119,121)/t78-,79-,80-,81-,82+,83+,84+,85+,88-,89-,90-,91-,147?,148?,149?,150?/m0/s1