Nh2-glu-lys-ser-leu-arg-gln-ile-glu-asn-asn-thr-arg-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

C₂₄₅H₃₉₅N₇₇O₇₉

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](CCCNC(=N)N)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)N

InChI

InChI=1S/C245H395N77O79/c1-28-114(13)187(318-201(362)127(26)283-203(364)140(52-40-90-268-240(256)257)291-230(391)167(106-186(351)352)315-227(388)162(101-130-107-274-136-48-34-32-46-133(130)136)308-200(361)125(24)281-206(367)150(67-80-178(335)336)300-226(387)163(102-131-108-275-137-49-35-33-47-134(131)137)311-211(372)144(56-44-94-272-244(264)265)303-238(399)191(128(27)324)322-232(393)166(105-176(255)332)314-229(390)165(104-175(254)331)313-219(380)157(74-87-185(349)350)305-237(398)189(116(15)30-3)320-222(383)149(66-78-173(252)329)296-208(369)142(54-42-92-270-242(260)261)293-225(386)159(97-111(7)8)309-233(394)169(109-323)317-212(373)138(50-36-38-88-246)289-202(363)135(248)62-79-177(333)334)234(395)285-126(25)197(358)288-153(70-83-181(341)342)218(379)310-161(100-129-58-60-132(325)61-59-129)223(384)284-120(19)194(355)276-121(20)195(356)286-145(57-45-95-273-245(266)267)221(382)319-188(115(14)29-2)236(397)304-152(69-82-180(339)340)207(368)282-124(23)199(360)307-160(98-112(9)10)231(392)321-190(117(16)31-4)235(396)302-141(53-41-91-269-241(258)259)204(365)279-118(17)192(353)277-122(21)196(357)287-146(63-75-170(249)326)213(374)298-155(72-85-183(345)346)217(378)295-147(64-76-171(250)327)214(375)294-148(65-77-172(251)328)215(376)299-154(71-84-182(343)344)216(377)290-139(51-37-39-89-247)210(371)312-164(103-174(253)330)228(389)301-151(68-81-179(337)338)205(366)280-119(18)193(354)278-123(22)198(359)306-158(96-110(5)6)224(385)292-143(55-43-93-271-243(262)263)209(370)297-156(73-86-184(347)348)220(381)316-168(239(400)401)99-113(11)12/h32-35,46-49,58-61,107-108,110-128,135,138-169,187-191,274-275,323-325H,28-31,36-45,50-57,62-106,109,246-248H2,1-27H3,(H2,249,326)(H2,250,327)(H2,251,328)(H2,252,329)(H2,253,330)(H2,254,331)(H2,255,332)(H,276,355)(H,277,353)(H,278,354)(H,279,365)(H,280,366)(H,281,367)(H,282,368)(H,283,364)(H,284,384)(H,285,395)(H,286,356)(H,287,357)(H,288,358)(H,289,363)(H,290,377)(H,291,391)(H,292,385)(H,293,386)(H,294,375)(H,295,378)(H,296,369)(H,297,370)(H,298,374)(H,299,376)(H,300,387)(H,301,389)(H,302,396)(H,303,399)(H,304,397)(H,305,398)(H,306,359)(H,307,360)(H,308,361)(H,309,394)(H,310,379)(H,311,372)(H,312,371)(H,313,380)(H,314,390)(H,315,388)(H,316,381)(H,317,373)(H,318,362)(H,319,382)(H,320,383)(H,321,392)(H,322,393)(H,333,334)(H,335,336)(H,337,338)(H,339,340)(H,341,342)(H,343,344)(H,345,346)(H,347,348)(H,349,350)(H,351,352)(H,400,401)(H4,256,257,268)(H4,258,259,269)(H4,260,261,270)(H4,262,263,271)(H4,264,265,272)(H4,266,267,273)/t114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128+,135-,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-,163-,164-,165-,166-,167-,168-,169-,187-,188-,189-,190-,191-/m0/s1

InChIKey

CZXZHCHFTGJJTD-BCYUIWBNSA-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)-2-[[(2S,3R)-2-[[(2S)-4-amino-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-4-carboxybutanoyl]amino]hexanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxybutanoyl]amino]-5-carbamimidamidopentanoyl]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 16134169