Nh2-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-cooh

Structural Information

Molecular Formula

C₂₃₄H₃₇₅N₇₃O₇₆

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)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC4=CNC5=CC=CC=C54)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)N

InChI

InChI=1S/C234H375N73O76/c1-30-106(10)177(303-195(348)122(26)271-198(351)137(53-42-88-255-231(246)247)282-222(375)160(100-176(333)334)300-220(373)156(96-127-101-259-132-48-35-33-46-130(127)132)296-193(346)119(23)269-202(355)146(66-78-169(319)320)290-219(372)157(97-128-102-260-133-49-36-34-47-131(128)133)301-227(380)180(124(28)308)307-228(381)181(125(29)309)306-196(349)123(27)273-217(370)158(98-166(242)315)297-194(347)120(24)268-197(350)136(52-41-87-254-230(244)245)281-207(360)141(61-73-162(238)311)277-188(341)115(19)263-184(337)111(15)266-200(353)145(65-77-168(317)318)286-204(357)134(50-37-39-85-235)275-182(335)109(13)237)224(377)274-121(25)190(343)279-149(69-81-172(325)326)213(366)298-155(95-126-57-59-129(310)60-58-126)216(369)272-113(17)186(339)261-114(18)187(340)276-140(56-45-91-258-234(252)253)215(368)304-178(107(11)31-2)226(379)293-148(68-80-171(323)324)203(356)270-118(22)192(345)295-154(93-104(6)7)223(376)305-179(108(12)32-3)225(378)292-138(54-43-89-256-232(248)249)199(352)265-110(14)183(336)262-116(20)189(342)278-142(62-74-163(239)312)208(361)288-151(71-83-174(329)330)212(365)285-143(63-75-164(240)313)209(362)284-144(64-76-165(241)314)210(363)289-150(70-82-173(327)328)211(364)280-135(51-38-40-86-236)206(359)299-159(99-167(243)316)221(374)291-147(67-79-170(321)322)201(354)267-112(16)185(338)264-117(21)191(344)294-153(92-103(4)5)218(371)283-139(55-44-90-257-233(250)251)205(358)287-152(72-84-175(331)332)214(367)302-161(229(382)383)94-105(8)9/h33-36,46-49,57-60,101-125,134-161,177-181,259-260,308-310H,30-32,37-45,50-56,61-100,235-237H2,1-29H3,(H2,238,311)(H2,239,312)(H2,240,313)(H2,241,314)(H2,242,315)(H2,243,316)(H,261,339)(H,262,336)(H,263,337)(H,264,338)(H,265,352)(H,266,353)(H,267,354)(H,268,350)(H,269,355)(H,270,356)(H,271,351)(H,272,369)(H,273,370)(H,274,377)(H,275,335)(H,276,340)(H,277,341)(H,278,342)(H,279,343)(H,280,364)(H,281,360)(H,282,375)(H,283,371)(H,284,362)(H,285,365)(H,286,357)(H,287,358)(H,288,361)(H,289,363)(H,290,372)(H,291,374)(H,292,378)(H,293,379)(H,294,344)(H,295,345)(H,296,346)(H,297,347)(H,298,366)(H,299,359)(H,300,373)(H,301,380)(H,302,367)(H,303,348)(H,304,368)(H,305,376)(H,306,349)(H,307,381)(H,317,318)(H,319,320)(H,321,322)(H,323,324)(H,325,326)(H,327,328)(H,329,330)(H,331,332)(H,333,334)(H,382,383)(H4,244,245,254)(H4,246,247,255)(H4,248,249,256)(H4,250,251,257)(H4,252,253,258)/t106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124+,125+,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,158-,159-,160-,161-,177-,178-,179-,180-,181-/m0/s1

InChIKey

JMMMCUMIHJASKT-QMWRTZLFSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(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-aminopropanoyl]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]-4-carboxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]propanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]-5-oxopentanoyl]amino]-5-oxopentanoyl]amino]-4-carboxybutanoyl]amino]hexanoyl]amino]-4-oxobutanoyl]amino]-4-carboxybutanoyl]amino]propanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoic acid

Related CIDs

• CID 16134166