Synonyms:
α-Thymidine, 5′-O-[[[5-[(6-chloro-2-methoxy-9-acridinyl)amino]pentyl]oxy]hydroxyphosphinyl]-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′)-, 3′-[O-[2-(4-azidophenyl)-2-oxoethyl] hydrogen phosphorothioate] (9CI)
Appearance:
Storage:
Store in 2-8°C for long term (months)
Boiling point:
Melting point:
Flash point:
Smiles:
N(CCCCCOP(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]8[C@@H](OP(OCC(=O)C9=CC=C(N=[N+]=[N-])C=C9)(=O)S)C[C@H](O8)N%10C(=O)NC(=O)C(C)=C%10)(=O)O)C[C@H](O7)N%11C(=O)NC(=O)C(C)=C%11)(=O)O)C[C@H](O6)N%12C(=O)NC(=O)C(C)=C%12)(=O)O)C[C@H](O5)N%13C(=O)NC(=O)C(C)=C%13)(=O)O)C[C@H](O4)N%14C(=O)NC(=O)C(C)=C%14)(=O)O)C[C@H](O3)N%15C(=O)NC(=O)C(C)=C%15)(=O)O)C[C@H](O2)N%16C(=O)NC(=O)C(C)=C%16)(=O)O)C[C@H](O1)N%17C(=O)NC(=O)C(C)=C%17)(=O)O)C=%18C%19=C(N=C%20C%18C=CC(Cl)=C%20)C=CC(OC)=C%19
InchiKey:
LVJZTJDYNGXQOS-UQONOJNZSA-N
Inchi:
InChI=1S/C107H131ClN21O61P9S/c1-50-33-122(100(139)112-92(50)131)83-25-67(75(175-83)42-166-191(147,148)165-22-12-10-11-21-110-91-62-19-15-59(108)23-65(62)111-64-20-18-61(164-9)24-63(64)91)183-192(149,150)167-43-76-68(26-84(176-76)123-34-51(2)93(132)113-101(123)140)184-193(151,152)168-44-77-69(27-85(177-77)124-35-52(3)94(133)114-102(124)141)185-194(153,154)169-45-78-70(28-86(178-78)125-36-53(4)95(134)115-103(125)142)186-195(155,156)170-46-79-71(29-87(179-79)126-37-54(5)96(135)116-104(126)143)187-196(157,158)171-47-80-72(30-88(180-80)127-38-55(6)97(136)117-105(127)144)188-197(159,160)172-48-81-73(31-89(181-81)128-39-56(7)98(137)118-106(128)145)189-198(161,162)173-49-82-74(32-90(182-82)129-40-57(8)99(138)119-107(129)146)190-199(163,200)174-41-66(130)58-13-16-60(17-14-58)120-121-109/h13-20,23-24,33-40,67-90H,10-12,21-22,25-32,41-49H2,1-9H3,(H,110,111)(H,147,148)(H,149,150)(H,151,152)(H,153,154)(H,155,156)(H,157,158)(H,159,160)(H,161,162)(H,163,200)(H,112,131,139)(H,113,132,140)(H,114,133,141)(H,115,134,142)(H,116,135,143)(H,117,136,144)(H,118,137,145)(H,119,138,146)/t67-,68-,69-,70-,71-,72-,73-,74-,75+,76+,77+,78+,79+,80+,81+,82+,83-,84-,85-,86-,87-,88-,89-,90-,199?/m0/s1