5-CFDA ethanedioic-S-phenylmethylester

Catalog Number

ACM690958191-1

CAS

690958-19-1

Synonyms

5-Carboxyfluorescein-diacetateethanedioic-S-phenylmethylester

IUPAC Name

[6'-acetyloxy-5-[(2-benzylsulfanyl-2-oxoethyl)carbamoyl]-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl]acetate

Molecular Weight

623.6

Molecular Formula

C34H25NO9S

Canonical SMILES

CC(=O)OC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)C(=O)NCC(=O)SCC5=CC=CC=C5)C(=O)O3)C6=C(O2)C=C(C=C6)OC(=O)C

InChI

InChI=1S/C34H25NO9S/c1-19(36)41-23-9-12-27-29(15-23)43-30-16-24(42-20(2)37)10-13-28(30)34(27)26-11-8-22(14-25(26)33(40)44-34)32(39)35-17-31(38)45-18-21-6-4-3-5-7-21/h3-16H,17-18H2,1-2H3,(H,35,39)

InChI Key

ZSIKQDVYTJYHOH-UHFFFAOYSA-N

Purity

97%+

Appearance

White powder

Storage

Stored at -20 °C

• Catalog Number: ACM690958191-1
• CAS: 690958-19-1
• Synonyms: 5-Carboxyfluorescein-diacetateethanedioic-S-phenylmethylester
• IUPAC Name: [6'-acetyloxy-5-[(2-benzylsulfanyl-2-oxoethyl)carbamoyl]-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl]acetate
• Molecular Weight: 623.6
• Molecular Formula: C34H25NO9S
• Canonical SMILES: CC(=O)OC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)C(=O)NCC(=O)SCC5=CC=CC=C5)C(=O)O3)C6=C(O2)C=C(C=C6)OC(=O)C
• InChI: InChI=1S/C34H25NO9S/c1-19(36)41-23-9-12-27-29(15-23)43-30-16-24(42-20(2)37)10-13-28(30)34(27)26-11-8-22(14-25(26)33(40)44-34)32(39)35-17-31(38)45-18-21-6-4-3-5-7-21/h3-16H,17-18H2,1-2H3,(H,35,39)
• InChI Key: ZSIKQDVYTJYHOH-UHFFFAOYSA-N
• Purity: 97%+
• Appearance: White powder
• Storage: Stored at -20 °C