Nh2-gly-ala-lys-glu-ala-ala-gln-arg-ala-asn-ala-thr-thr-trp-glu-ala-trp-asp-arg-ala-ile-ala-glu-tyr-ala-ala-arg-ile-glu-ala-leu-ile-arg-ala-ala-gln-glu-gln-gln-glu-lys-asn-glu-ala-ala-leu-arg-glu-leu-asp-lys-trp-ala-ser-leu-trp-asn-trp-phe-cooh

Structural Information

Molecular Formula

C₃₀₄H₄₆₁N₈₉O₉₁

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC6=CNC7=CC=CC=C76)C(=O)N[C@@H](CC8=CC=CC=C8)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC9=CNC1=CC=CC=C19)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN

InChI

InChI=1S/C304H461N89O91/c1-33-143(12)237(389-256(440)160(29)347-259(443)186(76-56-112-327-301(318)319)360-291(475)216(131-236(424)425)385-285(469)208(123-167-134-332-178-68-45-40-63-173(167)178)374-253(437)156(25)345-263(447)195(89-101-228(408)409)368-284(468)211(126-170-137-335-181-71-48-43-66-176(170)181)386-297(481)240(162(31)395)393-298(482)241(163(32)396)392-257(441)161(30)350-280(464)212(127-223(313)402)375-254(438)157(26)344-258(442)185(75-55-111-326-300(316)317)358-269(453)190(84-96-219(309)398)354-248(432)152(21)339-243(427)148(17)342-261(445)194(88-100-227(406)407)364-265(449)182(72-49-52-108-305)352-246(430)146(15)336-226(405)132-308)294(478)351-159(28)250(434)356-198(92-104-231(414)415)275(459)378-206(120-165-80-82-171(397)83-81-165)278(462)348-150(19)245(429)337-151(20)247(431)353-189(79-59-115-330-304(324)325)277(461)390-238(144(13)34-2)296(480)371-197(91-103-230(412)413)264(448)346-155(24)252(436)373-205(119-142(10)11)292(476)391-239(145(14)35-3)295(479)370-187(77-57-113-328-302(320)321)260(444)341-147(16)242(426)338-153(22)249(433)355-191(85-97-220(310)399)270(454)366-200(94-106-233(418)419)274(458)363-192(86-98-221(311)400)271(455)362-193(87-99-222(312)401)272(456)367-199(93-105-232(416)417)273(457)357-183(73-50-53-109-306)268(452)382-213(128-224(314)403)288(472)369-196(90-102-229(410)411)262(446)343-149(18)244(428)340-154(23)251(435)372-202(116-139(4)5)281(465)361-188(78-58-114-329-303(322)323)266(450)365-201(95-107-234(420)421)276(460)376-203(117-140(6)7)283(467)384-215(130-235(422)423)290(474)359-184(74-51-54-110-307)267(451)379-207(122-166-133-331-177-67-44-39-62-172(166)177)279(463)349-158(27)255(439)388-218(138-394)293(477)377-204(118-141(8)9)282(466)380-209(124-168-135-333-179-69-46-41-64-174(168)179)286(470)383-214(129-225(315)404)289(473)381-210(125-169-136-334-180-70-47-42-65-175(169)180)287(471)387-217(299(483)484)121-164-60-37-36-38-61-164/h36-48,60-71,80-83,133-137,139-163,182-218,237-241,331-335,394-397H,33-35,49-59,72-79,84-132,138,305-308H2,1-32H3,(H2,309,398)(H2,310,399)(H2,311,400)(H2,312,401)(H2,313,402)(H2,314,403)(H2,315,404)(H,336,405)(H,337,429)(H,338,426)(H,339,427)(H,340,428)(H,341,444)(H,342,445)(H,343,446)(H,344,442)(H,345,447)(H,346,448)(H,347,443)(H,348,462)(H,349,463)(H,350,464)(H,351,478)(H,352,430)(H,353,431)(H,354,432)(H,355,433)(H,356,434)(H,357,457)(H,358,453)(H,359,474)(H,360,475)(H,361,465)(H,362,455)(H,363,458)(H,364,449)(H,365,450)(H,366,454)(H,367,456)(H,368,468)(H,369,472)(H,370,479)(H,371,480)(H,372,435)(H,373,436)(H,374,437)(H,375,438)(H,376,460)(H,377,477)(H,378,459)(H,379,451)(H,380,466)(H,381,473)(H,382,452)(H,383,470)(H,384,467)(H,385,469)(H,386,481)(H,387,471)(H,388,439)(H,389,440)(H,390,461)(H,391,476)(H,392,441)(H,393,482)(H,406,407)(H,408,409)(H,410,411)(H,412,413)(H,414,415)(H,416,417)(H,418,419)(H,420,421)(H,422,423)(H,424,425)(H,483,484)(H4,316,317,326)(H4,318,319,327)(H4,320,321,328)(H4,322,323,329)(H4,324,325,330)/t143-,144-,145-,146-,147-,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,158-,159-,160-,161-,162+,163+,182-,183-,184-,185-,186-,187-,188-,189-,190-,191-,192-,193-,194-,195-,196-,197-,198-,199-,200-,201-,202-,203-,204-,205-,206-,207-,208-,209-,210-,211-,212-,213-,214-,215-,216-,217-,218-,237-,238-,239-,240-,241-/m0/s1

InChIKey

NUAIZTBDYBGGSX-WRHJCOHSSA-N

Compound name

(4S)-4-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[(2-aminoacetyl)amino]propanoyl]amino]hexanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-4-oxobutanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-carboxypropanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-4-amino-1-[[(2S)-1-[[(1S)-1-carboxy-2-phenylethyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

Related CIDs

• CID 16134206