Adrenomedullin (AM) (13-52), human

Iupac Name

(3S,6S,9S,12S,15S)-15-(((3S,6S,9S,12S,15S,18S,21S,24S,27S,30S,33S,36S,39S)-21-((1H-imidazol-5-yl)methyl)-1-((4R,7S,13S,16S,19R)-19-((2-(((S)-2-(((S)-2-amino-1,3-dihydroxypropylidene)amino)-1-hydroxy-3-phenylpropylidene)amino)-1-hydroxyethylidene)amino)-13-benzyl-16-(3-guanidinopropyl)-6,9,12,15,18-pentahydroxy-7-((R)-1-hydroxyethyl)-1,2-dithia-5,8,11,14,17-pentaazacycloicosa-5,8,11,14,17-pentaen-4-yl)-12-(4-aminobutyl)-36-benzyl-27-((S)-sec-butyl)-1,4,7,10,13,16,19,22,25,28,31,34,37,40-tetradecahydroxy-9,24,33-tris(3-hydroxy-3-iminopropyl)-30-(4-hydroxybenzyl)-3,39-bis((R)-1-hydroxyethyl)-15-isobutyl-6-isopropyl-18-methyl-2,5,8,11,14,17,20,23,26,29,32,35,38-tridecaazatetraconta-1,4,7,10,13,16,19,22,25,28,31,34,37-tridecaen-40-ylidene)amino)-6,12-bis(4-aminobutyl)-3-((((S)-1-(((S)-1-(((S)-1-((S)-2-((3S,6S,9S,12S,15S)-9-(4-aminobutyl)-12-((S)-sec-butyl)-16-((S)-2-((((S)-1,5-dihydroxy-1-((2-hydroxy-2-(((S)-1-hydroxy-3-(4-hydroxyphenyl)-1-iminopropan-2-yl)imino)ethyl)imino)-5-iminopentan-2-yl)imino)(hydroxy)methyl)pyrrolidin-1-yl)-3-(3-guanidinopropyl)-1,4,7,10,13-pentahydroxy-6,15-bis(hydroxymethyl)-16-oxo-2,5,8,11,14-pentaazahexadeca-1,4,7,10,13-pentaen-1-yl)pyrrolidin-1-yl)-1-oxopropan-2-yl)imino)-1-hydroxy-3-methylbutan-2-yl)imino)-1,4-dihydroxy-4-iminobutan-2-yl)imino)(hydroxy)methyl)-9-(carboxymethyl)-5,8,11,14-tetrahydroxy-4,7,10,13-tetraazaheptadeca-4,7,10,13-tetraenedioic acid

Inchi Code

1S/C200H308N58O59S2/c1-16-101(9)157(254-176(295)126(64-68-147(209)270)233-179(298)133(83-113-88-216-97-222-113)237-163(282)103(11)223-177(296)128(77-98(3)4)239-168(287)117(45-27-31-69-201)227-173(292)125(63-67-146(208)269)236-191(310)156(100(7)8)252-196(315)161(107(15)264)256-187(306)141-96-319-318-95-140(226-150(273)90-220-166(285)129(238-164(283)116(205)92-259)79-108-39-21-18-22-40-108)186(305)231-121(49-35-73-217-199(212)213)171(290)240-130(80-109-41-23-19-24-42-109)167(286)221-91-151(274)250-159(105(13)262)194(313)249-141)192(311)245-131(82-112-55-59-115(266)60-56-112)178(297)232-124(62-66-145(207)268)174(293)241-132(81-110-43-25-20-26-44-110)183(302)255-160(106(14)263)195(314)246-137(87-154(279)280)181(300)229-119(47-29-33-71-203)169(288)243-135(85-152(275)276)180(299)228-118(46-28-32-70-202)170(289)244-136(86-153(277)278)182(301)242-134(84-148(210)271)184(303)251-155(99(5)6)190(309)224-104(12)197(316)257-75-37-51-142(257)188(307)234-122(50-36-74-218-200(214)215)172(291)247-138(93-260)185(304)230-120(48-30-34-72-204)175(294)253-158(102(10)17-2)193(312)248-139(94-261)198(317)258-76-38-52-143(258)189(308)235-123(61-65-144(206)267)165(284)219-89-149(272)225-127(162(211)281)78-111-53-57-114(265)58-54-111/h18-26,39-44,53-60,88,97-107,116-143,155-161,259-266H,16-17,27-38,45-52,61-87,89-96,201-205H2,1-15H3,(H2,206,267)(H2,207,268)(H2,208,269)(H2,209,270)(H2,210,271)(H2,211,281)(H,216,222)(H,219,284)(H,220,285)(H,221,286)(H,223,296)(H,224,309)(H,225,272)(H,226,273)(H,227,292)(H,228,299)(H,229,300)(H,230,304)(H,231,305)(H,232,297)(H,233,298)(H,234,307)(H,235,308)(H,236,310)(H,237,282)(H,238,283)(H,239,287)(H,240,290)(H,241,293)(H,242,301)(H,243,288)(H,244,289)(H,245,311)(H,246,314)(H,247,291)(H,248,312)(H,249,313)(H,250,274)(H,251,303)(H,252,315)(H,253,294)(H,254,295)(H,255,302)(H,256,306)(H,275,276)(H,277,278)(H,279,280)(H4,212,213,217)(H4,214,215,218)/t101-,102-,103-,104-,105+,106+,107+,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,155-,156-,157-,158-,159-,160-,161-/m0/s1

InChI key

XWJQADVZUMCZIU-KLEDEOSNSA-N