Basic Information |
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| Product Name： | PROPERDISTATIN |
| English Synonyms： | GPWEPCSVTCSKGTRTRRR ; GLY-PRO-TRP-GLU-PRO-CYS-SER-VAL-THR-CYS-SER-LYS-GLY-THR-ARG-THR-ARG-ARG-ARG ; PROPERDISTATIN |
| MDL Number.： | MFCD11656192 |
| H bond acceptor： | 60 |
| H bond donor： | 38 |
| Smile： | CC(C)[C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc2c[nH]c3c2cccc3)NC(=O)[C@@H]4CCCN4C(=O)CN |
| InChi： | InChI=1S/C89H149N33O27S2/c1-42(2)65(118-75(138)57(39-124)114-76(139)58(40-150)115-79(142)61-24-15-33-122(61)84(147)53(25-26-64(130)131)110-73(136)55(34-46-36-104-48-17-7-6-16-47(46)48)112-78(141)60-23-14-32-121(60)63(129)35-91)80(143)120-68(45(5)127)83(146)116-59(41-151)77(140)113-56(38-123)74(137)106-49(18-8-9-27-90)69(132)105-37-62(128)117-66(43(3)125)81(144)109-52(21-12-30-102-88(96)97)72(135)119-67(44(4)126)82(145)108-51(20-11-29-101-87(94)95)70(133)107-50(19-10-28-100-86(92)93)71(134)111-54(85(148)149)22-13-31-103-89(98)99/h6-7,16-17,36,42-45,49-61,65-68,104,123-127,150-151H,8-15,18-35,37-41,90-91H2,1-5H3,(H,105,132)(H,106,137)(H,107,133)(H,108,145)(H,109,144)(H,110,136)(H,111,134)(H,112,141)(H,113,140)(H,114,139)(H,115,142)(H,116,146)(H,117,128)(H,118,138)(H,119,135)(H,120,143)(H,130,131)(H,148,149)(H4,92,93,100)(H4,94,95,101)(H4,96,97,102)(H4,98,99,103)/t43-,44-,45-,49+,50+,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61+,65+,66+,67+,68+/m1/s1 |
| InChiKey： | InChIKey=BFDYBJWURCHKCV-YZBQNZNFSA-N |
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