[tcccaggctcagatc]

Structural Information

Molecular Formula

C₁₆₂H₂₀₅N₈₅O₄₆S

SMILES

CC1=CN(C(=O)NC1=O)CC(=O)N(CCNC(=O)C)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)NCS)C(=O)CN2C=CC(=NC2=O)N)C(=O)CN3C=C(C(=O)NC3=O)C)C(=O)CN4C=NC5=C(N=CN=C54)N)C(=O)CN6C=NC7=C6N=C(NC7=O)N)C(=O)CN8C=NC9=C(N=CN=C98)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=C(C(=O)NC1=O)C)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=C(N=CN=C21)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=CC(=NC1=O)N)C(=O)CN1C=CC(=NC1=O)N

InChI

InChI=1S/C162H205N85O46S/c1-90-47-239(160(291)215-145(90)279)71-121(270)218(32-11-175-93(4)248)50-100(249)176-12-33-219(115(264)65-233-26-5-94(163)203-154(233)285)51-101(250)177-13-34-220(116(265)66-234-27-6-95(164)204-155(234)286)52-102(251)178-14-35-221(117(266)67-235-28-7-96(165)205-156(235)287)54-104(253)183-19-40-226(124(273)74-242-83-196-130-136(169)190-80-193-139(130)242)60-110(259)187-23-44-231(129(278)79-247-88-201-135-144(247)211-153(174)214-150(135)284)63-113(262)188-24-45-229(127(276)77-245-86-199-133-142(245)209-151(172)212-148(133)282)61-111(260)180-16-37-223(119(268)69-237-30-9-98(167)207-158(237)289)53-103(252)181-17-38-224(122(271)72-240-48-91(2)146(280)216-161(240)292)56-106(255)179-15-36-222(118(267)68-236-29-8-97(166)206-157(236)288)55-105(254)184-20-41-227(125(274)75-243-84-197-131-137(170)191-81-194-140(131)243)59-109(258)186-22-43-230(128(277)78-246-87-200-134-143(246)210-152(173)213-149(134)283)62-112(261)185-21-42-228(126(275)76-244-85-198-132-138(171)192-82-195-141(132)244)58-108(257)182-18-39-225(123(272)73-241-49-92(3)147(281)217-162(241)293)57-107(256)189-25-46-232(64-114(263)202-89-294)120(269)70-238-31-10-99(168)208-159(238)290/h5-10,26-31,47-49,80-88,294H,11-25,32-46,50-79,89H2,1-4H3,(H,175,248)(H,176,249)(H,177,250)(H,178,251)(H,179,255)(H,180,260)(H,181,252)(H,182,257)(H,183,253)(H,184,254)(H,185,261)(H,186,258)(H,187,259)(H,188,262)(H,189,256)(H,202,263)(H2,163,203,285)(H2,164,204,286)(H2,165,205,287)(H2,166,206,288)(H2,167,207,289)(H2,168,208,290)(H2,169,190,193)(H2,170,191,194)(H2,171,192,195)(H,215,279,291)(H,216,280,292)(H,217,281,293)(H3,172,209,212,282)(H3,173,210,213,283)(H3,174,211,214,284)

InChIKey

DHWJFYPTAURQOG-UHFFFAOYSA-N

Compound name

N-[2-[[2-[2-acetamidoethyl-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]acetyl]amino]ethyl]-N-[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]-[2-[2-[[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]-[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-[2-[[2-(2-amino-6-oxo-1H-purin-9-yl)acetyl]-[2-[2-[[2-[2-[[2-[2-[[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]-[2-oxo-2-(sulfanylmethylamino)ethyl]amino]ethylamino]-2-oxoethyl]-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]ethylamino]-2-oxoethyl]-[2-(6-aminopurin-9-yl)acetyl]amino]ethylamino]-2-oxoethyl]amino]ethylamino]-2-oxoethyl]-[2-(6-aminopurin-9-yl)acetyl]amino]ethylamino]-2-oxoethyl]-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]ethylamino]-2-oxoethyl]-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]ethylamino]-2-oxoethyl]-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]ethylamino]-2-oxoethyl]amino]ethylamino]-2-oxoethyl]amino]ethylamino]-2-oxoethyl]-[2-(6-aminopurin-9-yl)acetyl]amino]ethylamino]-2-oxoethyl]-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]ethylamino]-2-oxoethyl]-[2-(4-amino-2-oxopyrimidin-1-yl)acetyl]amino]ethylamino]-2-oxoethyl]-2-(4-amino-2-oxopyrimidin-1-yl)acetamide

Related CIDs

• CID 16131519