CAS NO: | 112748-19-3 |
中文别名 | Scyliorhinin II(cas:112748-19-3) |
英文别名 | Scyliorhinin II,112748-19-3 |
CAS号 | 112748-19-3 |
SMILES | CC(C)C[C@@H](C(=N[C@@H](CCSC)C(=N)O)O)N=C(CN=C([C@H](C(C)C)N=C([C@H](Cc1ccccc1)N=C([C@@H]/2CSSC[C@@H](C(=O)N3CCC[C@H]3/C(=N\[C@H](/C(=N\CC(=O)N4CCC[C@H]4/C(=N\[C@H](/C(=N2)/O)CC(=O)O)/O)/O)CC(=O)O)/O)N=C([C@H](CCCCN)N=C([C@H](CO)N=C([C@H](CC(=N)O)N=C([C@H](CO)N=C([C@@H]5CCCN5C(=O)[C@H](CO)N)O)O)O)O)O)O)O)O)O |
Inchi | InChI=1S/C77H119N21O26S3/c1-38(2)26-44(65(112)85-42(62(81)109)20-25-125-5)84-57(103)31-82-75(122)61(39(3)4)95-68(115)45(27-40-14-7-6-8-15-40)87-71(118)51-36-126-127-37-52(77(124)98-24-13-19-55(98)73(120)89-47(29-59(105)106)63(110)83-32-58(104)96-22-11-17-53(96)72(119)90-48(30-60(107)108)67(114)93-51)94-64(111)43(16-9-10-21-78)86-69(116)49(34-100)91-66(113)46(28-56(80)102)88-70(117)50(35-101)92-74(121)54-18-12-23-97(54)76(123)41(79)33-99/h6-8,14-15,38-39,41-55,61,99-101H,9-13,16-37,78-79H2,1-5H3,(H2,80,102)(H2,81,109)(H,82,122)(H,83,110)(H,84,103)(H,85,112)(H,86,116)(H,87,118)(H,88,117)(H,89,120)(H,90,119)(H,91,113)(H,92,121)(H,93,114)(H,94,111)(H,95,115)(H,105,106)(H,107,108)/t41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,61-/m0/s1 |
InchiKey | BIVHHUZLTJIRQO-BAPDVVNWSA-N |
分子式 Formula | C77H119N21O26S3 |
分子量 Molecular Weight | 1851.09 |
闪点 FP | 1052.9±37.1 ℃ |
沸点 Boiling point | 1817.4±75.0 ℃ at 760 mmHg |
Polarizability极化度 | 179.0±0.5 10-24cm3 |
密度 Density | 1.6±0.1 g/cm3 |
蒸汽压 Vapor Pressure | 0.0±0.3 mmHg at 25℃ |
性状 | Solid |
储藏条件 Storage conditions | 请根据产品建议的存储条件进行存储,Please store the product under the recommended condition sin the description. |