INDOLICIDIN

CAS No.
140896-21-5
CCD No.
CCD00098710
Formula
C100 H132 N26 O13
MolWeight
1906.31

Basic Information

Product Name: INDOLICIDIN
CAS: 140896-21-5
English Synonyms: ILPWKWPWWPWRR-NH2 ; INDOLICIDIN ; ILE-LEU-PRO-TRP-LYS-TRP-PRO-TRP-TRP-PRO-TRP-ARG-ARG-NH2 ; H-ILE-LEU-PRO-TRP-LYS-TRP-PRO-TRP-TRP-PRO-TRP-ARG-ARG-NH2
MDL Number.: MFCD00214306
H bond acceptor: 39
H bond donor: 23
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc2c[nH]c3c2cccc3)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc4c[nH]c5c4cccc5)C(=O)N6CCC[C@H]6C(=O)N[C@@H](Cc7c[nH]c8c7cccc8)C(=O)N[C@@H](Cc9c[nH]c1c9cccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CCCNC(=N)N)C(=O)N)N
InChi: InChI=1S/C100H132N26O13/c1-5-57(4)85(102)95(136)123-79(45-56(2)3)96(137)124-42-20-36-82(124)92(133)118-76(46-58-51-110-68-28-11-6-23-63(58)68)89(130)116-74(33-16-17-39-101)88(129)121-80(49-61-54-113-71-31-14-9-26-66(61)71)97(138)125-43-21-38-84(125)94(135)120-78(48-60-53-112-70-30-13-8-25-65(60)70)91(132)122-81(50-62-55-114-72-32-15-10-27-67(62)72)98(139)126-44-22-37-83(126)93(134)119-77(47-59-52-111-69-29-12-7-24-64(59)69)90(131)117-75(35-19-41-109-100(106)107)87(128)115-73(86(103)127)34-18-40-108-99(104)105/h6-15,23-32,51-57,73-85,110-114H,5,16-22,33-50,101-102H2,1-4H3,(H2,103,127)(H,115,128)(H,116,130)(H,117,131)(H,118,133)(H,119,134)(H,120,135)(H,121,129)(H,122,132)(H,123,136)(H4,104,105,108)(H4,106,107,109)/t57-,73+,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-/m0/s1
InChiKey: InChIKey=USSYUMHVHQSYNA-YDSZHKBTSA-N

Property

Comments: MERCK: 14,10224
ORIGINAL SKU: J65215-!D
ORIGINAL SKU: J65215-M^
RTECS: NM1890250
UNSPSC: 12000000

Safety information

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