basic_info |
|
| Product_Name: | UROCORTIN, (HUMAN), [(125I)-TYRO] |
| EnglishSynonyms: | UROCORTIN, (HUMAN), [(125I)-TYRO] |
| pro_mdlNumber: | MFCD09954049 |
| pro_acceptors: | 130 |
| pro_donors: | 76 |
| pro_smile: | CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc5ccc(c(c5)[125I])O)N |
| InChi: | InChI=1S/C213H345IN64O66/c1-28-104(20)162(273-200(336)147(94-282)268-188(324)133(77-100(12)13)258-198(334)145(92-280)270-201(337)148-52-42-72-278(148)208(344)143(86-154(220)291)266-194(330)140(87-158(298)299)252-171(307)117(215)81-114-53-60-149(286)116(214)80-114)202(338)265-142(89-160(302)303)193(329)257-135(79-102(16)17)196(332)277-167(111(27)285)207(343)264-137(83-113-45-35-32-36-46-113)189(325)259-138(84-115-90-232-95-238-115)191(327)256-132(76-99(10)11)186(322)254-130(74-97(6)7)184(320)245-122(51-41-71-237-213(230)231)182(318)276-166(110(26)284)206(342)262-134(78-101(14)15)187(323)255-131(75-98(8)9)185(321)249-128(59-66-157(296)297)178(314)253-129(73-96(4)5)183(319)240-108(24)169(305)241-120(49-39-69-235-211(226)227)181(317)275-165(109(25)283)205(341)251-125(56-63-152(218)289)179(315)267-144(91-279)197(333)250-123(54-61-150(216)287)174(310)244-119(48-38-68-234-210(224)225)173(309)248-127(58-65-156(294)295)176(312)243-118(47-37-67-233-209(222)223)172(308)239-107(23)170(306)242-126(57-64-155(292)293)175(311)247-124(55-62-151(217)288)177(313)260-139(85-153(219)290)192(328)246-121(50-40-70-236-212(228)229)180(316)272-164(106(22)30-3)204(340)274-163(105(21)29-2)203(339)263-136(82-112-43-33-31-34-44-112)190(326)261-141(88-159(300)301)195(331)269-146(93-281)199(335)271-161(103(18)19)168(221)304/h31-36,43-46,53,60,80,90,95-111,117-148,161-167,279-286H,28-30,37-42,47-52,54-59,61-79,81-89,91-94,215H2,1-27H3,(H2,216,287)(H2,217,288)(H2,218,289)(H2,219,290)(H2,220,291)(H2,221,304)(H,232,238)(H,239,308)(H,240,319)(H,241,305)(H,242,306)(H,243,312)(H,244,310)(H,245,320)(H,246,328)(H,247,311)(H,248,309)(H,249,321)(H,250,333)(H,251,341)(H,252,307)(H,253,314)(H,254,322)(H,255,323)(H,256,327)(H,257,329)(H,258,334)(H,259,325)(H,260,313)(H,261,326)(H,262,342)(H,263,339)(H,264,343)(H,265,338)(H,266,330)(H,267,315)(H,268,324)(H,269,331)(H,270,337)(H,271,335)(H,272,316)(H,273,336)(H,274,340)(H,275,317)(H,276,318)(H,277,332)(H,292,293)(H,294,295)(H,296,297)(H,298,299)(H,300,301)(H,302,303)(H4,222,223,233)(H4,224,225,234)(H4,226,227,235)(H4,228,229,236)(H4,230,231,237)/t104-,105-,106-,107-,108-,109+,110+,111+,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148-,161-,162-,163-,164-,165-,166-,167-/m0/s1/i214-2 |
| InChiKey: | InChIKey=MKQLDQOENZDHSD-HZFKRSEDSA-N |
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