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Substance Name: Iroplact [INN]
RN: 154248-96-1
UNII: T381WW8L8Y
InChIKey: UKJQICHUOMUQMN-WGKJRWQSSA-N

Molecular Formula

  • C346-H585-N97-O102-S5

Molecular Weight

  • 7896.3345
 
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Names and Synonyms

Name of Substance

  • Iroplact [INN]

Synonyms

  • Iroplact
  • UNII-T381WW8L8Y

Systematic Name

  • N-L-Methionyl blood platelet factor 4 (human subunit)

Registry Numbers

CAS Registry Number

  • 154248-96-1

FDA UNII

  • T381WW8L8Y

System Generated Number

  • 0154248961

Structure Descriptors

InChI

1S/C346H585N97O102S5/c1-50-177(33)265-329(530)379-186(42)279(480)435-272(189(45)448)336(537)418-226(141-172(23)24)306(507)390-202(82-59-67-120-350)290(491)413-231(146-250(360)457)281(482)372-152-251(458)382-198(87-72-125-369-344(361)362)286(487)388-204(84-61-69-122-352)297(498)429-266(178(34)51-2)332(533)424-239(320(521)409-223(138-169(17)18)308(509)415-234(149-261(475)476)314(515)407-220(135-166(11)12)302(503)393-208(98-107-246(356)453)285(486)381-187(43)340(541)441-129-76-91-243(441)324(525)416-225(140-171(21)22)309(510)411-228(143-193-94-96-196(452)97-95-193)311(512)391-200(80-57-65-118-348)287(488)389-205(85-62-70-123-353)298(499)430-269(181(37)54-5)333(534)434-268(180(36)53-4)331(532)401-203(83-60-68-121-351)288(489)387-201(81-58-66-119-349)289(490)403-222(137-168(15)16)307(508)405-218(133-164(7)8)304(505)395-215(105-114-257(467)468)295(496)421-237(157-446)343(544)545)159-547-548-160-240-321(522)428-262(174(27)28)326(527)399-206(86-63-71-124-354)299(500)436-275(192(48)451)339(540)439-274(191(47)450)338(539)419-235(155-444)317(518)397-211(101-110-249(359)456)300(501)426-263(175(29)30)327(528)402-217(89-74-127-371-346(365)366)341(542)442-130-77-92-244(442)323(524)398-207(88-73-126-370-345(363)364)291(492)412-230(145-195-151-368-163-376-195)316(517)432-270(182(38)55-6)334(535)438-273(190(46)449)337(538)420-236(156-445)318(519)408-221(136-167(13)14)305(506)396-216(106-115-258(469)470)301(502)427-264(176(31)32)328(529)433-267(179(35)52-3)330(531)400-199(79-56-64-117-347)283(484)377-183(39)276(477)374-154-253(460)440-128-75-90-242(440)322(523)417-229(144-194-150-367-162-375-194)312(513)425-241(342(543)443-131-78-93-245(443)325(526)437-271(188(44)447)335(536)380-185(41)278(479)384-209(99-108-247(357)454)293(494)404-227(142-173(25)26)315(516)431-265)161-550-549-158-238(319(520)410-224(139-170(19)20)310(511)423-240)422-296(497)210(100-109-248(358)455)394-303(504)219(134-165(9)10)406-313(514)233(148-260(473)474)383-252(459)153-373-282(483)232(147-259(471)472)414-294(495)214(104-113-256(465)466)392-292(493)213(103-112-255(463)464)385-277(478)184(40)378-284(485)212(102-111-254(461)462)386-280(481)197(355)116-132-546-49/h94-97,150-151,162-192,197-245,262-275,444-452H,50-93,98-149,152-161,347-355H2,1-49H3,(H2,356,453)(H2,357,454)(H2,358,455)(H2,359,456)(H2,360,457)(H,367,375)(H,368,376)(H,372,482)(H,373,483)(H,374,477)(H,377,484)(H,378,485)(H,379,530)(H,380,536)(H,381,486)(H,382,458)(H,383,459)(H,384,479)(H,385,478)(H,386,481)(H,387,489)(H,388,487)(H,389,488)(H,390,507)(H,391,512)(H,392,493)(H,393,503)(H,394,504)(H,395,505)(H,396,506)(H,397,518)(H,398,524)(H,399,527)(H,400,531)(H,401,532)(H,402,528)(H,403,490)(H,404,494)(H,405,508)(H,406,514)(H,407,515)(H,408,519)(H,409,521)(H,410,520)(H,411,510)(H,412,492)(H,413,491)(H,414,495)(H,415,509)(H,416,525)(H,417,523)(H,418,537)(H,419,539)(H,420,538)(H,421,496)(H,422,497)(H,423,511)(H,424,533)(H,425,513)(H,426,501)(H,427,502)(H,428,522)(H,429,498)(H,430,499)(H,431,516)(H,432,517)(H,433,529)(H,434,534)(H,435,480)(H,436,500)(H,437,526)(H,438,535)(H,439,540)(H,461,462)(H,463,464)(H,465,466)(H,467,468)(H,469,470)(H,471,472)(H,473,474)(H,475,476)(H,544,545)(H4,361,362,369)(H4,363,364,370)(H4,365,366,371)/t177-,178-,179-,180-,181-,182-,183-,184-,185-,186-,187-,188+,189+,190+,191+,192+,197-,198-,199-,200-,201-,202-,203-,204-,205-,206-,207-,208-,209-,210-,211-,212-,213-,214-,215-,216-,217-,218-,219-,220-,221-,222-,223-,224-,225-,226-,227-,228-,229-,230-,231-,232-,233-,234-,235-,236-,237-,238-,239-,240-,241-,242-,243-,244-,245-,262-,263-,264-,265-,266-,267-,268-,269-,270-,271-,272-,273-,274-,275-/m0/s1

InChIKey

UKJQICHUOMUQMN-WGKJRWQSSA-N

Smiles

CC[C@H](C)[C@H]1C(=O)N[C@@H](CSSC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N2)CC(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)N)C(=O)N5CCC[C@H]5C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCCCN)CCCNC(=N)N)CC(=O)N)CCCCN)CC(C)C)[C@@H](C)O)C)[C@@H](C)CC)CC(C)C)CCC(=O)N)C)[C@@H](C)O)Cc6cnc[nH]6)C)CCCCN)[C@@H](C)CC)C(C)C)CCC(=O)O)CC(C)C)CO)[C@@H](C)O)[C@@H](C)CC)Cc7cnc[nH]7)CCCNC(=N)N)CCCNC(=N)N)C(C)C)CCC(=O)N)CO)[C@@H](C)O)[C@@H](C)O)CCCCN)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N8CCC[C@H]8C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc9ccc(cc9)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O