SIVMAC239-68_Chemical Cloud Database

SIVMAC239-68

Basic Information
Product Name：	SIVMAC239-68
English Synonyms：	SIVMAC239-68 ; H-LEU-GLY-LEU-GLN-LYS-CYS-VAL-ARG-MET-TYR-ASN-PRO-THR-ASN-ILE-OH ; LGLQKCVRMYNPTNI
MDL Number.：	MFCD03790714
H bond acceptor：	43
H bond donor：	24
Smile：	CC[C@H](C)[C@@H](C(=O)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)N)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)N
InChi：	InChI=1S/C76H128N22O21S2/c1-11-40(8)60(75(118)119)96-69(112)51(33-56(80)102)92-73(116)61(41(9)99)97-71(114)54-18-15-28-98(54)74(117)52(34-57(81)103)93-68(111)50(32-42-19-21-43(100)22-20-42)91-66(109)48(25-29-121-10)89-63(106)46(17-14-27-84-76(82)83)90-72(115)59(39(6)7)95-70(113)53(36-120)94-64(107)45(16-12-13-26-77)87-65(108)47(23-24-55(79)101)88-67(110)49(31-38(4)5)86-58(104)35-85-62(105)44(78)30-37(2)3/h19-22,37-41,44-54,59-61,99-100,120H,11-18,23-36,77-78H2,1-10H3,(H2,79,101)(H2,80,102)(H2,81,103)(H,85,105)(H,86,104)(H,87,108)(H,88,110)(H,89,106)(H,90,115)(H,91,109)(H,92,116)(H,93,111)(H,94,107)(H,95,113)(H,96,112)(H,97,114)(H,118,119)(H4,82,83,84)/t40-,41+,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,59-,60-,61-/m0/s1
InChiKey：	InChIKey=SOISLIRQAHSOGE-QJGPOHTISA-N

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