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IUPAC Name: 2-[(4S)-3,9-bis(carboxymethyl)-4-[(4-isothiocyanatophenyl)methyl]-3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(14),11(15),12-trien-6-yl]acetic acid | CAS Registry Number: 949147-44-8Synonyms: UNII-79XFT02E12, 79XFT02E12, p-SCN-Bn-pcta, SCHEMBL4097440, (4S)-4-((4-Isothiocyanatophenyl)methyl)-3,6,9,15-tetraazabicyclo(9.3.1)pentadeca-1(15),11,13-triene-3,6,9-triacetic acid, 3,6,9,15-Tetraazabicyclo(9.3.1)pentadeca-1(15),11,13-triene-3,6,9-triacetic acid, 4-((4-isothiocyanatophenyl)methyl)-, (4S)-
| Molecular Formula: | C25H29N5O6S | Molecular Weight: | 527.600 [g/mol] |
| H-Bond Donor: | 3 | H-Bond Acceptor: | 12 |
InChIKey: FSOBASOXWBKMSC-QFIPXVFZSA-N
