Basic Information |
|
| Product Name： | NODULARIN |
| CAS： | 118399-22-7 |
| English Synonyms： | CYCLO[(2S,3S,4E,6E,8S,9S)-3-AMINO-9-METHOXY-2,6,8-TRIMETHYL-10-PHENYL-4,6-DECADIENOYL-D-GAMMA-GLUTAMYL-(2Z)-2-(METHYLAMINO)-2-BUTENOYL-(3S)-3-METHYL-DBETA-ASPARTYL-L-ARGINYL] ; CYCLO(3S-AMINO-9S-METHOXY-2S,6E,8S-TRIMETHYL-10-PHENYL-4,6-DECADIENOYL-D-GAMMA-GLUTAMYL-(2Z)-2-(METHYLAMINO)-2-BUTENOYL-(3S)-3-METHYL-D-BETA-ASPARTYL-L-ARGINYL) ; 1,4,8,11,15-PENTAAZACYCLONONADECANE, CYCLIC PEPTIDE ; NODULARIA SPUMIGENA ; NODULARIN |
| MDL Number.： | MFCD16659855 |
| H bond acceptor： | 18 |
| H bond donor： | 9 |
| Smile： | C/C=C\1/C(=O)N[C@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H]([C@@H](C(=O)N[C@H](CCC(=O)N1C)C(=O)O)C)/C=C/C(=C/[C@H](C)[C@H](Cc2ccccc2)OC)/C)CCCNC(=N)N)C)C(=O)O |
| InChi： | InChI=1S/C41H60N8O10/c1-8-31-38(54)48-34(40(57)58)26(5)36(52)46-29(15-12-20-44-41(42)43)37(53)45-28(25(4)35(51)47-30(39(55)56)18-19-33(50)49(31)6)17-16-23(2)21-24(3)32(59-7)22-27-13-10-9-11-14-27/h8-11,13-14,16-17,21,24-26,28-30,32,34H,12,15,18-20,22H2,1-7H3,(H,45,53)(H,46,52)(H,47,51)(H,48,54)(H,55,56)(H,57,58)(H4,42,43,44)/b17-16+,23-21+,31-8-/t24-,25-,26-,28-,29-,30+,32-,34+/m0/s1 |
| InChiKey： | InChIKey=IXBQSRWSVIBXNC-HSKGSTCASA-N |
Property |
|
| Physical Property： | FLASHPOINT: 11 DEG C FLASHPOINT: 51.8 DEG F |
| Comments： | CONCENTRATION: 10 MICROGRAM/ML IN METHANOL FOR ENVIRONMENTAL ANALYSIS FORM: SOLUTION STORAGE TEMPERATURE: -20 DEG C WGK: 1 |
| Specification： | ANALYTICAL STANDARD |
| Concentration： | 10 MICROGRAM/ML IN METHANOL |
Safety information |
|
| Symbol： |
GHS06
|
| Signal word： | Danger |
| Hazard statements： | H300 +H310 + H330-H315-H317-H319-H335 |
| Precautionary statements： | P260-P264-P280-P284-P301 + P310-P302 + P350 |
| hazard symbol： | T+ |
| Risk Code： | R:26/27/28-36/37/38-43 |
| Safe Code： | S:26-36/37/39-45 |
| WGK Germany： | 3 |
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