Molecular Structure:
CCD No.:CCD00416860
SIVMAC239 ENVELOPE-25
Formula:C97 H157 N27 O29 S3
MolWeight:2261.67
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| Product Name： | SIVMAC239 ENVELOPE-25 |
| English Synonyms： | SIVMAC239 ENVELOPE-25 ; H-LEU-ARG-CYS-ASN-ASP-THR-ASN-TYR-SER-GLY-PHE-MET-PRO-LYS-CYS-SER-LYS-VAL-VAL-VAL-OH ; LRCNDTNYSGFMPKCSKVVV |
| MDL Number.： | MFCD03790794 |
| H bond acceptor： | 56 |
| H bond donor： | 32 |
| Smile： | CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCSC)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)O)N |
| InChi： | InChI=1S/C97H157N27O29S3/c1-47(2)36-55(100)78(134)108-58(24-18-33-105-97(103)104)81(137)118-67(45-154)89(145)113-62(39-70(101)129)85(141)114-64(41-73(132)133)87(143)123-77(51(9)127)94(150)115-63(40-71(102)130)86(142)112-61(38-53-26-28-54(128)29-27-53)84(140)116-65(43-125)79(135)106-42-72(131)107-60(37-52-20-12-11-13-21-52)83(139)111-59(30-35-156-10)95(151)124-34-19-25-69(124)91(147)110-56(22-14-16-31-98)80(136)119-68(46-155)90(146)117-66(44-126)88(144)109-57(23-15-17-32-99)82(138)120-74(48(3)4)92(148)121-75(49(5)6)93(149)122-76(50(7)8)96(152)153/h11-13,20-21,26-29,47-51,55-69,74-77,125-128,154-155H,14-19,22-25,30-46,98-100H2,1-10H3,(H2,101,129)(H2,102,130)(H,106,135)(H,107,131)(H,108,134)(H,109,144)(H,110,147)(H,111,139)(H,112,142)(H,113,145)(H,114,141)(H,115,150)(H,116,140)(H,117,146)(H,118,137)(H,119,136)(H,120,138)(H,121,148)(H,122,149)(H,123,143)(H,132,133)(H,152,153)(H4,103,104,105)/t51-,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,74+,75+,76+,77+/m1/s1 |
| InChiKey： | InChIKey=DGMSKHGUAUNSSO-ZNYMLRSYSA-N |
Basic Information
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