VIP(6-28)(human, rat, porcine, bovine) acetate

Iupac Name

(3S,6S,9S,12S,15S,18S,21S,24S,27S,30S,33S,36S,39S,42S,45S,48S,51S,54S,57S,60S,63S)-63-(((2S,3R)-2-(((S)-2-amino-1-hydroxy-3-phenylpropylidene)amino)-1,3-dihydroxybutylidene)amino)-24,27,42-tris(4-aminobutyl)-9-((S)-sec-butyl)-45,51-bis(3-guanidinopropyl)-1,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62-henicosahydroxy-3-(hydroxy(imino)methyl)-15,60-bis(2-hydroxy-2-iminoethyl)-39-(3-hydroxy-3-iminopropyl)-21,57-bis(4-hydroxybenzyl)-54-((R)-1-hydroxyethyl)-12-(hydroxymethyl)-1-imino-6,18,48-triisobutyl-30-isopropyl-33-methyl-36-(2-(methylthio)ethyl)-4,7,10,13,16,19,22,25,28,31,34,37,40,43,46,49,52,55,58,61-icosaazapentahexaconta-4,7,10,13,16,19,22,25,28,31,34,37,40,43,46,49,52,55,58,61-icosaen-65-oic acid--acetic acid (1/1)

Inchi Code

1S/C126H207N37O34S.C2H4O2/c1-15-66(10)99(122(195)157-86(53-64(6)7)113(186)150-83(102(135)175)57-94(132)170)161-120(193)92(61-164)159-117(190)90(59-96(134)172)155-114(187)85(52-63(4)5)152-115(188)87(55-71-34-38-73(167)39-35-71)153-109(182)77(30-20-23-46-128)144-107(180)78(31-21-24-47-129)148-121(194)98(65(8)9)160-103(176)67(11)142-105(178)82(44-50-198-14)147-111(184)81(42-43-93(131)169)146-106(179)76(29-19-22-45-127)143-108(181)79(32-25-48-140-125(136)137)145-112(185)84(51-62(2)3)151-110(183)80(33-26-49-141-126(138)139)149-123(196)101(69(13)166)163-119(192)88(56-72-36-40-74(168)41-37-72)154-116(189)89(58-95(133)171)156-118(191)91(60-97(173)174)158-124(197)100(68(12)165)162-104(177)75(130)54-70-27-17-16-18-28-70;1-2(3)4/h16-18,27-28,34-41,62-69,75-92,98-101,164-168H,15,19-26,29-33,42-61,127-130H2,1-14H3,(H2,131,169)(H2,132,170)(H2,133,171)(H2,134,172)(H2,135,175)(H,142,178)(H,143,181)(H,144,180)(H,145,185)(H,146,179)(H,147,184)(H,148,194)(H,149,196)(H,150,186)(H,151,183)(H,152,188)(H,153,182)(H,154,189)(H,155,187)(H,156,191)(H,157,195)(H,158,197)(H,159,190)(H,160,176)(H,161,193)(H,162,177)(H,163,192)(H,173,174)(H4,136,137,140)(H4,138,139,141);1H3,(H,3,4)/t66-,67-,68+,69+,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,98-,99-,100-,101-;/m0./s1

InChI key

MELFEJPMJZDPGU-ADRIUKKESA-N