2-[2-[3-[2-[1,3-DIHYDRO-3,3-DIMETHYL-1-(4-SULFOBUTYL)-2H-INDOL-2-YLIDENE]ETHYLIDENE]]-2-(2-PROPYN-1-YLAMINO)-1-CYCLOPENTEN-1-YL]ETHENYL-3,3-DIMETHYL-1-(4-SULFOBUTYL)-3H-INDOLIUM INNER SALT

pro_cas
1188292-54-7
pro_cdbregno
CCD04205999
pro_formula
C40 H49 N3 O6 S2
pro_molWeight
731.974

basic_info

Product_Name: 2-[2-[3-[2-[1,3-DIHYDRO-3,3-DIMETHYL-1-(4-SULFOBUTYL)-2H-INDOL-2-YLIDENE]ETHYLIDENE]]-2-(2-PROPYN-1-YLAMINO)-1-CYCLOPENTEN-1-YL]ETHENYL-3,3-DIMETHYL-1-(4-SULFOBUTYL)-3H-INDOLIUM INNER SALT
CAS: 1188292-54-7
EnglishSynonyms: 2-[2-[3-[2-[1,3-DIHYDRO-3,3-DIMETHYL-1-(4-SULFOBUTYL)-2H-INDOL-2-YLIDENE]ETHYLIDENE]]-2-(2-PROPYN-1-YLAMINO)-1-CYCLOPENTEN-1-YL]ETHENYL-3,3-DIMETHYL-1-(4-SULFOBUTYL)-3H-INDOLIUM INNER SALT ; ALKYNE CYANINE DYE 718
pro_mdlNumber: MFCD18452828
pro_acceptors: 9
pro_donors: 2
pro_smile: CC1(c2ccccc2[N+](=C1/C=C/C3=C(/C(=C/C=C/4\C(c5ccccc5N4CCCCS(=O)(=O)O)(C)C)/CC3)NCC#C)CCCCS(=O)(=O)[O-])C
InChi: InChI=1S/C40H49N3O6S2/c1-6-25-41-38-30(21-23-36-39(2,3)32-15-7-9-17-34(32)42(36)26-11-13-28-50(44,45)46)19-20-31(38)22-24-37-40(4,5)33-16-8-10-18-35(33)43(37)27-12-14-29-51(47,48)49/h1,7-10,15-18,21-24H,11-14,19-20,25-29H2,2-5H3,(H2,44,45,46,47,48,49)/b30-21+,36-23+
InChiKey: InChIKey=YNKZQYLIDKIPBB-GBYGALLISA-N

property

secure_info

secure_wgk_germany: 3

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