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-cooh

Structural Information

Molecular Formula

C₂₃₆H₃₇₈N₇₄O₇₇

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)NC(=O)CN

InChI

InChI=1S/C236H378N74O77/c1-30-107(10)179(306-197(352)123(26)274-200(355)138(53-42-88-257-233(248)249)285-224(379)161(100-178(337)338)303-222(377)157(96-128-102-261-133-48-35-33-46-131(128)133)299-195(350)120(23)272-204(359)147(66-78-171(323)324)293-221(376)158(97-129-103-262-134-49-36-34-47-132(129)134)304-229(384)182(125(28)311)310-230(385)183(126(29)312)309-198(353)124(27)276-219(374)159(98-167(244)318)300-196(351)121(24)271-199(354)137(52-41-87-256-232(246)247)284-209(364)142(61-73-163(240)314)280-190(345)116(19)266-185(340)112(15)269-202(357)146(65-77-170(321)322)289-206(361)135(50-37-39-85-237)278-188(343)110(13)263-169(320)101-239)226(381)277-122(25)192(347)282-150(69-81-174(329)330)215(370)301-156(95-127-57-59-130(313)60-58-127)218(373)275-114(17)187(342)264-115(18)189(344)279-141(56-45-91-260-236(254)255)217(372)307-180(108(11)31-2)228(383)296-149(68-80-173(327)328)205(360)273-119(22)194(349)298-155(93-105(6)7)225(380)308-181(109(12)32-3)227(382)295-139(54-43-89-258-234(250)251)201(356)268-111(14)184(339)265-117(20)191(346)281-143(62-74-164(241)315)210(365)291-152(71-83-176(333)334)214(369)288-144(63-75-165(242)316)211(366)287-145(64-76-166(243)317)212(367)292-151(70-82-175(331)332)213(368)283-136(51-38-40-86-238)208(363)302-160(99-168(245)319)223(378)294-148(67-79-172(325)326)203(358)270-113(16)186(341)267-118(21)193(348)297-154(92-104(4)5)220(375)286-140(55-44-90-259-235(252)253)207(362)290-153(72-84-177(335)336)216(371)305-162(231(386)387)94-106(8)9/h33-36,46-49,57-60,102-126,135-162,179-183,261-262,311-313H,30-32,37-45,50-56,61-101,237-239H2,1-29H3,(H2,240,314)(H2,241,315)(H2,242,316)(H2,243,317)(H2,244,318)(H2,245,319)(H,263,320)(H,264,342)(H,265,339)(H,266,340)(H,267,341)(H,268,356)(H,269,357)(H,270,358)(H,271,354)(H,272,359)(H,273,360)(H,274,355)(H,275,373)(H,276,374)(H,277,381)(H,278,343)(H,279,344)(H,280,345)(H,281,346)(H,282,347)(H,283,368)(H,284,364)(H,285,379)(H,286,375)(H,287,366)(H,288,369)(H,289,361)(H,290,362)(H,291,365)(H,292,367)(H,293,376)(H,294,378)(H,295,382)(H,296,383)(H,297,348)(H,298,349)(H,299,350)(H,300,351)(H,301,370)(H,302,363)(H,303,377)(H,304,384)(H,305,371)(H,306,352)(H,307,372)(H,308,380)(H,309,353)(H,310,385)(H,321,322)(H,323,324)(H,325,326)(H,327,328)(H,329,330)(H,331,332)(H,333,334)(H,335,336)(H,337,338)(H,386,387)(H4,246,247,256)(H4,248,249,257)(H4,250,251,258)(H4,252,253,259)(H4,254,255,260)/t107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125+,126+,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-,162-,179-,180-,181-,182-,183-/m0/s1

InChIKey

USFVWCZUAVURQI-JIXXWBCMSA-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-[(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]-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 16134173