CID 16131517
Gtccctgttcgggcgccactg-lys
Structural Information
- Molecular Formula
- C231H294N118O70
- SMILES
- CC1=CN(C(=O)NC1=O)CC(=O)N(CCNC(=O)CN(CCNC(=O)C)C(=O)CN2C=NC3=C2N=C(NC3=O)N)CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NCCN(CC(=O)NC(CCCCN)C(=O)O)C(=O)CN4C=NC5=C4N=C(NC5=O)N)C(=O)CN6C=C(C(=O)NC6=O)C)C(=O)CN7C=CC(=NC7=O)N)C(=O)CN8C=NC9=C(N=CN=C98)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=NC2=C1N=C(NC2=O)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=NC2=C1N=C(NC2=O)N)C(=O)CN1C=NC2=C1N=C(NC2=O)N)C(=O)CN1C=NC2=C1N=C(NC2=O)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=C(C(=O)NC1=O)C)C(=O)CN1C=C(C(=O)NC1=O)C)C(=O)CN1C=NC2=C1N=C(NC2=O)N)C(=O)CN1C=C(C(=O)NC1=O)C)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=CC(=NC1=O)N
- InChI
- InChI=1S/C231H294N118O70/c1-125-69-337(227(415)303-199(125)393)103-169(380)317(57-28-258-140(351)74-308(48-19-249-130(6)350)175(386)109-343-118-273-183-192(343)289-212(242)296-204(183)398)83-149(360)253-23-52-312(164(375)98-332-43-13-135(236)284-222(332)410)76-142(353)250-20-49-309(161(372)95-329-40-10-132(233)281-219(329)407)75-141(352)251-21-50-310(162(373)96-330-41-11-133(234)282-220(330)408)78-144(355)259-29-58-318(170(381)104-338-70-126(2)200(394)304-228(338)416)86-152(363)266-36-65-325(178(389)112-346-121-276-186-195(346)292-215(245)299-207(186)401)91-157(368)262-32-61-320(172(383)106-340-72-128(4)202(396)306-230(340)418)85-151(362)261-31-60-319(171(382)105-339-71-127(3)201(395)305-229(339)417)84-150(361)254-24-53-313(165(376)99-333-44-14-136(237)285-223(333)411)81-147(358)265-35-64-324(177(388)111-345-120-275-185-194(345)291-214(244)298-206(185)400)92-158(369)268-38-67-327(180(391)114-348-123-278-188-197(348)294-217(247)301-209(188)403)93-159(370)267-37-66-326(179(390)113-347-122-277-187-196(347)293-216(246)300-208(187)402)90-156(367)257-27-56-316(168(379)102-336-47-17-139(240)288-226(336)414)82-148(359)264-34-63-323(176(387)110-344-119-274-184-193(344)290-213(243)297-205(184)399)89-155(366)256-26-55-314(166(377)100-334-45-15-137(238)286-224(334)412)77-143(354)252-22-51-311(163(374)97-331-42-12-134(235)283-221(331)409)80-146(357)263-33-62-322(174(385)108-342-117-272-182-190(241)270-116-271-191(182)342)88-154(365)255-25-54-315(167(378)101-335-46-16-138(239)287-225(335)413)79-145(356)260-30-59-321(173(384)107-341-73-129(5)203(397)307-231(341)419)87-153(364)269-39-68-328(94-160(371)280-131(211(405)406)9-7-8-18-232)181(392)115-349-124-279-189-198(349)295-218(248)302-210(189)404/h10-17,40-47,69-73,116-124,131H,7-9,18-39,48-68,74-115,232H2,1-6H3,(H,249,350)(H,250,353)(H,251,352)(H,252,354)(H,253,360)(H,254,361)(H,255,365)(H,256,366)(H,257,367)(H,258,351)(H,259,355)(H,260,356)(H,261,362)(H,262,368)(H,263,357)(H,264,359)(H,265,358)(H,266,363)(H,267,370)(H,268,369)(H,269,364)(H,280,371)(H,405,406)(H2,233,281,407)(H2,234,282,408)(H2,235,283,409)(H2,236,284,410)(H2,237,285,411)(H2,238,286,412)(H2,239,287,413)(H2,240,288,414)(H2,241,270,271)(H,303,393,415)(H,304,394,416)(H,305,395,417)(H,306,396,418)(H,307,397,419)(H3,242,289,296,398)(H3,243,290,297,399)(H3,244,291,298,400)(H3,245,292,299,401)(H3,246,293,300,402)(H3,247,294,301,403)(H3,248,295,302,404)
- InChIKey
- PVHJCBCGMYMWOJ-UHFFFAOYSA-N
- Compound name
- 2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-acetamidoethyl-[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]amino]acetyl]amino]ethyl-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]amino]acetyl]amino]ethyl-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]amino]acetyl]amino]ethyl-[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]amino]acetyl]amino]ethyl-[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(6-aminopurin-9-yl)acetyl]amino]acetyl]amino]ethyl-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl-[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]amino]acetyl]amino]-6-aminohexanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 5841.3143 | 311.0 |
[M+Na]+ | 5863.2962 | 311.0 |
[M-H]- | 5839.2997 | 311.0 |
[M+NH4]+ | 5858.3408 | 311.0 |
[M+K]+ | 5879.2702 | 311.0 |
[M+H-H2O]+ | 5823.3043 | 311.0 |
[M+HCOO]- | 5885.3052 | 311.0 |
[M+CH3COO]- | 5899.3209 | 311.0 |
[M+Na-2H]- | 5861.2817 | 311.1 |
[M]+ | 5840.3065 | 311.0 |
[M]- | 5840.3075 | 311.0 |
Literature stripe
Patent stripe
No patent data available for this compound.