DABCYL-GLU-ARG-NLE-PHE-LEU-SER-PHE-PRO-EDANS

CAS No.
263718-22-5
CCD No.
CCD08050413
Formula
C76 H98 N16 O15 S
MolWeight
1507.77

Basic Information

Product Name: DABCYL-GLU-ARG-NLE-PHE-LEU-SER-PHE-PRO-EDANS
CAS: 263718-22-5
English Synonyms: MALARIA ASPARTYL PROTEINASE FRET SUBSTRATE I ; DABCYL-GLU-ARG-NLE-PHE-LEU-SER-PHE-PRO-EDANS
MDL Number.: MFCD00672485
H bond acceptor: 31
H bond donor: 15
Smile: CCCC[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccccc2)C(=O)N3CCC[C@H]3C(=O)NCCNc4cccc5c4cccc5S(=O)(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)c6ccc(cc6)/N=N/c7ccc(cc7)N(C)C
InChi: InChI=1S/C76H98N16O15S/c1-6-7-24-57(83-68(97)58(26-16-39-81-76(77)78)84-70(99)59(37-38-66(94)95)82-67(96)50-29-31-51(32-30-50)89-90-52-33-35-53(36-34-52)91(4)5)69(98)86-61(44-48-18-10-8-11-19-48)72(101)85-60(43-47(2)3)71(100)88-63(46-93)73(102)87-62(45-49-20-12-9-13-21-49)75(104)92-42-17-27-64(92)74(103)80-41-40-79-56-25-14-23-55-54(56)22-15-28-65(55)108(105,106)107/h8-15,18-23,25,28-36,47,57-64,79,93H,6-7,16-17,24,26-27,37-46H2,1-5H3,(H,80,103)(H,82,96)(H,83,97)(H,84,99)(H,85,101)(H,86,98)(H,87,102)(H,88,100)(H,94,95)(H4,77,78,81)(H,105,106,107)/b90-89+/t57-,58-,59-,60-,61-,62-,63-,64-/m0/s1
InChiKey: InChIKey=WIGNAGQVAHRNIM-KNKCKCLCSA-N

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