Molecular Structure:
CCD No.:CCD00176386
IOTASUL
CAS No.:
71767-13-0
Formula:C38 H50 I6 N6 O14 S
MolWeight:1608.31
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| Product Name： | IOTASUL |
| CAS： | 71767-13-0 |
| English Synonyms： | IOTASUL |
| MDL Number.： | MFCD00867940 |
| H bond acceptor： | 20 |
| H bond donor： | 10 |
| Smile： | CN(CC(CO)O)C(=O)c1c(c(c(c(c1I)NC(=O)CCSCCC(=O)Nc2c(c(c(c(c2I)C(=O)N(C)CC(CO)O)I)C(=O)N(C)CC(CO)O)I)I)C(=O)N(C)CC(CO)O)I |
| InChi： | InChI=1S/C38H50I6N6O14S/c1-47(9-17(55)13-51)35(61)23-27(39)24(36(62)48(2)10-18(56)14-52)30(42)33(29(23)41)45-21(59)5-7-65-8-6-22(60)46-34-31(43)25(37(63)49(3)11-19(57)15-53)28(40)26(32(34)44)38(64)50(4)12-20(58)16-54/h17-20,51-58H,5-16H2,1-4H3,(H,45,59)(H,46,60) |
| InChiKey： | InChIKey=OQHLOKBHRXMXLD-UHFFFAOYSA-N |
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