Analyte Name

5(6)-Carboxy-X-rhodamine N-Succinimidyl Ester

CAS Number

114616-32-9

Molecular Formula

C37H33N3O7

Molecular Weight

631.67

Accurate Mass

631.23

SMILES

O=C(OC12C3=CC4=C5C(CCCN5CCC4)=C3OC6=C2C=C7CCCN8C7=C6CCC8)C9=C1C=C(C(ON%10C(CCC%10=O)=O)=O)C=C9.O=C(OC%11%12C%13=CC%14=C%15C(CCCN%15CCC%14)=C%13OC%16=C%12C=C%17CCCN%18C%17=C%16CCC%18)C%19=C%11C=CC(C(ON%20C(CCC%20=O)=O)=O)=C%19.O=C(OC%21%22C%23=CC%24=C%25C(CCCN%25CCC%24)=C%23OC%26=C%22C=C%27CCCN%28C%27=C%26CCC%28)C%29=C%21C=CC=C%29C(ON%30C(CCC%30=O)=O)=O.O=C(OC%31%32C%33=CC%34=C%35C(CCCN%35CCC%34)=C%33OC%36=C%32C=C%37CCCN%38C%37=C%36CCC%38)C%39=C%31C(C(ON%40C(CCC%40=O)=O)=O)=CC=C%39

InChI

InChI=1S/4C37H33N3O7/c41-28-12-13-29(42)40(28)47-35(43)22-8-1-11-25-30(22)36(44)46-37(25)26-18-20-6-2-14-38-16-4-9-23(31(20)38)33(26)45-34-24-10-5-17-39-15-3-7-21(32(24)39)19-27(34)37;41-28-12-13-29(42)40(28)47-36(44)23-9-1-8-22-30(23)37(46-35(22)43)26-18-20-6-2-14-38-16-4-10-24(31(20)38)33(26)45-34-25-11-5-17-39-15-3-7-21(32(25)39)19-27(34)37;41-29-11-12-30(42)40(29)47-35(43)22-9-10-26-25(17-22)36(44)46-37(26)27-18-20-5-1-13-38-15-3-7-23(31(20)38)33(27)45-34-24-8-4-16-39-14-2-6-21(32(24)39)19-28(34)37;41-29-11-12-30(42)40(29)47-35(43)22-9-10-23-26(19-22)37(46-36(23)44)27-17-20-5-1-13-38-15-3-7-24(31(20)38)33(27)45-34-25-8-4-16-39-14-2-6-21(32(25)39)18-28(34)37/h1,8,11,18-19H,2-7,9-10,12-17H2;1,8-9,18-19H,2-7,10-17H2;2*9-10,17-19H,1-8,11-16H2

IUPAC

(2,5-dioxopyrrolidin-1-yl) acetate;spiro[2-benzofuran-3,16'-3-oxa-9,23-diazaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,13(28),14,18-hexaene]-1-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Contaminant

Product Format

Neat