basic_info |
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| Product_Name: | 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE-N-(LISSAMINE RHODAMINE B SULFONYL) AMMONIUM SALT |
| CAS: | 384833-00-5 |
| EnglishSynonyms: | 1,2-DIOLEOYL-SN-GLYCERO-3-PHOSPHOETHANOLAMINE-N-(LISSAMINE RHODAMINE B SULFONYL) AMMONIUM SALT ; 18:1 LISS RHOD PE AMMONIUM SALT |
| pro_mdlNumber: | MFCD22495273 |
| pro_acceptors: | 17 |
| pro_donors: | 2 |
| pro_smile: | CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCNS(=O)(=O)c1ccc(c(c1)S(=O)(=O)[O-])c2c3ccc(cc3oc-4cc(=[N+](CC)CC)ccc24)N(CC)CC)OC(=O)CCCCCCC/C=C\CCCCCCCC.N |
| InChi: | InChI=1S/C68H106N3O14PS2.H3N/c1-7-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-66(72)81-54-58(84-67(73)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-8-2)55-83-86(74,75)82-50-49-69-87(76,77)59-45-48-62(65(53-59)88(78,79)80)68-60-46-43-56(70(9-3)10-4)51-63(60)85-64-52-57(44-47-61(64)68)71(11-5)12-6;/h25-28,43-48,51-53,58,69H,7-24,29-42,49-50,54-55H2,1-6H3,(H-,74,75,78,79,80);1H3/b27-25-,28-26-;/t58-;/m1./s1 |
| InChiKey: | InChIKey=CGRUMBHIZFKVJB-CJYGVCEBSA-N |
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