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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: 949147-44-8| Molecular Formula: | C25H29N5O6S | Molecular Weight: | 527.600 [g/mol] |
| H-Bond Donor: | 3 | H-Bond Acceptor: | 12 |
InChIKey: FSOBASOXWBKMSC-QFIPXVFZSA-N