Synonyms:
α-Thymidine, 5′-O-[mercapto[2-oxo-2-(1,10-phenanthrolin-5-ylamino)ethoxy]phosphinyl]-α-thymidylyl-(3′→5′)-α-thymidylyl-(3′→5′)-α-thymidylyl-(3′→5′)-α-thymidylyl-(3′→5′)-α-thymidylyl-(3′→5′)-α-thymidylyl-(3′→5′)-α-thymidylyl-(3′→5′)- (9CI)
Appearance:
Storage:
Store in 2-8°C for long term (months)
Boiling point:
Melting point:
Flash point:
Smiles:
N(C(COP(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(OC[C@@H]5[C@@H](OP(OC[C@@H]6[C@@H](OP(OC[C@@H]7[C@@H](OP(OC[C@H]8O[C@@H](C[C@@H]8O)N9C(=O)NC(=O)C(C)=C9)(=O)O)C[C@H](O7)N%10C(=O)NC(=O)C(C)=C%10)(=O)O)C[C@H](O6)N%11C(=O)NC(=O)C(C)=C%11)(=O)O)C[C@H](O5)N%12C(=O)NC(=O)C(C)=C%12)(=O)O)C[C@H](O4)N%13C(=O)NC(=O)C(C)=C%13)(=O)O)C[C@H](O3)N%14C(=O)NC(=O)C(C)=C%14)(=O)O)C[C@H](O2)N%15C(=O)NC(=O)C(C)=C%15)(=O)O)C[C@H](O1)N%16C(=O)NC(=O)C(C)=C%16)(=O)S)=O)C%17=C%18C(=C%19C(=C%17)C=CC=N%19)N=CC=C%18
InchiKey:
CGMSFAAVRLNYIX-WFIZUTPJSA-N
Inchi:
InChI=1S/C94H115N19O57P8S/c1-41-24-106(87(124)98-79(41)116)69-16-52(114)60(156-69)32-147-171(132,133)164-53-17-70(107-25-42(2)80(117)99-88(107)125)157-61(53)33-148-172(134,135)165-54-18-71(108-26-43(3)81(118)100-89(108)126)158-62(54)34-149-173(136,137)166-55-19-72(109-27-44(4)82(119)101-90(109)127)159-63(55)35-150-174(138,139)167-56-20-73(110-28-45(5)83(120)102-91(110)128)160-64(56)36-151-175(140,141)168-57-21-74(111-29-46(6)84(121)103-92(111)129)161-65(57)37-152-176(142,143)169-58-22-75(112-30-47(7)85(122)104-93(112)130)162-66(58)38-153-177(144,145)170-59-23-76(113-31-48(8)86(123)105-94(113)131)163-67(59)39-154-178(146,179)155-40-68(115)97-51-15-49-11-9-13-95-77(49)78-50(51)12-10-14-96-78/h9-15,24-31,52-67,69-76,114H,16-23,32-40H2,1-8H3,(H,97,115)(H,132,133)(H,134,135)(H,136,137)(H,138,139)(H,140,141)(H,142,143)(H,144,145)(H,146,179)(H,98,116,124)(H,99,117,125)(H,100,118,126)(H,101,119,127)(H,102,120,128)(H,103,121,129)(H,104,122,130)(H,105,123,131)/t52-,53-,54-,55-,56-,57-,58-,59-,60+,61+,62+,63+,64+,65+,66+,67+,69-,70-,71-,72-,73-,74-,75-,76-,178?/m0/s1
