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Substance Name: Proinsulin human [USAN]
RN: 67422-14-4
UNII: D91579HJ6E
InChIKey: HMGKTWZKXKVNHR-QPQIXQCSSA-N

Classification Code

  • Antidiabetic

Molecular Formula

  • C410-H638-N114-O127-S6

Molecular Weight

  • 9388.6172
 
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Names and Synonyms

Name of Substance

  • Proinsulin human [USAN]

Synonyms

  • LY167005
  • Proinsulin (human)
  • Proinsulin human
  • UNII-D91579HJ6E

Systematic Name

  • Proinsulin (pig), 30-L-threonine-36-L-aspartic acid-37-L-leucine-39-L-valine-41-L-glutamine-48-L-proline-49a-endo-L-alanine-50a-endo-L-serine-53-L-proline-59-L-serine-60-L-leucine-

Registry Numbers

CAS Registry Number

  • 67422-14-4

FDA UNII

  • D91579HJ6E

System Generated Number

  • 0067422144

Structure Descriptors

InChI

1S/C410H638N114O127S6/c1-48-209(39)327-401(645)517-326(208(37)38)397(641)477-250(114-129-318(570)571)350(594)467-244(105-120-295(418)541)356(600)506-285-186-655-656-187-286-388(632)503-280(181-528)385(629)490-261(148-199(19)20)367(611)491-267(155-221-85-93-227(533)94-86-221)370(614)470-242(103-118-293(416)539)351(595)483-257(144-195(11)12)362(606)473-249(113-128-317(568)569)354(598)498-273(161-298(421)544)377(621)494-269(157-223-89-97-229(535)98-90-223)373(617)507-284(387(631)502-276(406(650)651)163-300(423)546)185-654-653-184-283(509-399(643)325(207(35)36)516-379(623)263(150-201(23)24)486-371(615)268(156-222-87-95-228(534)96-88-222)492-366(610)256(143-194(9)10)481-334(578)213(43)453-344(588)247(111-126-315(564)565)476-396(640)324(206(33)34)515-380(624)264(151-202(25)26)487-375(619)272(160-226-166-433-190-450-226)497-384(628)279(180-527)460-309(555)174-446-341(585)282(183-652-657-188-287(508-389(285)633)390(634)520-330(216(46)531)403(647)504-281(182-529)386(630)518-328(210(40)49-2)400(644)510-286)505-368(612)262(149-200(21)22)484-374(618)271(159-225-165-432-189-449-225)496-352(596)243(104-119-294(417)540)471-376(620)274(162-299(422)545)501-398(642)322(204(29)30)512-336(580)231(413)152-218-70-53-50-54-71-218)342(586)445-171-304(550)456-240(109-124-313(560)561)348(592)463-233(79-64-134-435-408(426)427)337(581)442-172-306(552)457-265(153-219-72-55-51-56-73-219)369(613)493-266(154-220-74-57-52-58-75-220)372(616)495-270(158-224-91-99-230(536)100-92-224)381(625)521-331(217(47)532)405(649)524-139-69-84-290(524)392(636)474-235(77-60-62-132-412)357(601)519-329(215(45)530)402(646)475-237(81-66-136-437-410(430)431)347(591)465-236(80-65-135-436-409(428)429)346(590)468-246(110-125-314(562)563)343(587)452-212(42)333(577)461-248(112-127-316(566)567)353(597)499-275(164-320(574)575)378(622)485-258(145-196(13)14)363(607)472-245(106-121-296(419)542)359(603)513-321(203(27)28)394(638)448-175-305(551)455-239(101-116-291(414)537)358(602)514-323(205(31)32)395(639)478-251(115-130-319(572)573)355(599)482-253(140-191(3)4)340(584)441-168-302(548)438-167-301(547)439-177-311(557)522-137-67-82-288(522)391(635)447-169-303(549)451-211(41)332(576)440-170-307(553)458-277(178-525)383(627)489-260(147-198(17)18)365(609)479-252(107-122-297(420)543)404(648)523-138-68-83-289(523)393(637)500-254(141-192(5)6)360(604)454-214(44)335(579)480-255(142-193(7)8)361(605)466-238(108-123-312(558)559)339(583)443-173-308(554)459-278(179-526)382(626)488-259(146-197(15)16)364(608)469-241(102-117-292(415)538)349(593)464-234(76-59-61-131-411)345(589)462-232(78-63-133-434-407(424)425)338(582)444-176-310(556)511-327/h50-58,70-75,85-100,165-166,189-217,231-290,321-331,525-536H,48-49,59-69,76-84,101-164,167-188,411-413H2,1-47H3,(H2,414,537)(H2,415,538)(H2,416,539)(H2,417,540)(H2,418,541)(H2,419,542)(H2,420,543)(H2,421,544)(H2,422,545)(H2,423,546)(H,432,449)(H,433,450)(H,438,548)(H,439,547)(H,440,576)(H,441,584)(H,442,581)(H,443,583)(H,444,582)(H,445,586)(H,446,585)(H,447,635)(H,448,638)(H,451,549)(H,452,587)(H,453,588)(H,454,604)(H,455,551)(H,456,550)(H,457,552)(H,458,553)(H,459,554)(H,460,555)(H,461,577)(H,462,589)(H,463,592)(H,464,593)(H,465,591)(H,466,605)(H,467,594)(H,468,590)(H,469,608)(H,470,614)(H,471,620)(H,472,607)(H,473,606)(H,474,636)(H,475,646)(H,476,640)(H,477,641)(H,478,639)(H,479,609)(H,480,579)(H,481,578)(H,482,599)(H,483,595)(H,484,618)(H,485,622)(H,486,615)(H,487,619)(H,488,626)(H,489,627)(H,490,629)(H,491,611)(H,492,610)(H,493,613)(H,494,621)(H,495,616)(H,496,596)(H,497,628)(H,498,598)(H,499,597)(H,500,637)(H,501,642)(H,502,631)(H,503,632)(H,504,647)(H,505,612)(H,506,600)(H,507,617)(H,508,633)(H,509,643)(H,510,644)(H,511,556)(H,512,580)(H,513,603)(H,514,602)(H,515,624)(H,516,623)(H,517,645)(H,518,630)(H,519,601)(H,520,634)(H,521,625)(H,558,559)(H,560,561)(H,562,563)(H,564,565)(H,566,567)(H,568,569)(H,570,571)(H,572,573)(H,574,575)(H,650,651)(H4,424,425,434)(H4,426,427,435)(H4,428,429,436)(H4,430,431,437)/t209-,210-,211-,212-,213-,214-,215+,216+,217+,231-,232-,233-,234-,235-,236-,237-,238-,239-,240-,241-,242-,243-,244-,245-,246-,247-,248-,249-,250-,251-,252-,253-,254-,255-,256-,257-,258-,259-,260-,261-,262-,263-,264-,265-,266-,267-,268-,269-,270-,271-,272-,273-,274-,275-,276-,277-,278-,279-,280-,281-,282-,283-,284-,285-,286-,287-,288-,289-,290-,321-,322-,323-,324-,325-,326-,327-,328-,329-,330-,331-/m0/s1

InChIKey

HMGKTWZKXKVNHR-QPQIXQCSSA-N

Smiles

CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]2CSSC[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](CSSC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N4CCC[C@H]4C(=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)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)NCC(=O)N5CCC[C@H]5C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N6CCC[C@H]6C(=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)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N1)CCCNC(=N)N)CCCCN)CCC(=O)N)CC(C)C)CO)CCC(=O)O)CC(C)C)C)CC(C)C)CCC(=O)N)CC(C)C)CO)C)CC(C)C)CCC(=O)O)C(C)C)CCC(=O)N)C(C)C)CCC(=O)N)CC(C)C)CC(=O)O)CCC(=O)O)C)CCC(=O)O)CCCNC(=N)N)CCCNC(=N)N)[C@@H](C)O)CCCCN)[C@@H](C)O)Cc7ccc(cc7)O)Cc8ccccc8)Cc9ccccc9)CCCNC(=N)N)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3)[C@@H](C)CC)CO)[C@@H](C)O)NC2=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccccc1)N)CO)Cc1cnc[nH]1)CC(C)C)C(C)C)CCC(=O)O)C)CC(C)C)Cc1ccc(cc1)O)CC(C)C)C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)O)Cc1ccc(cc1)O)CC(=O)N)CCC(=O)O)CC(C)C)CCC(=O)N)Cc1ccc(cc1)O)CC(C)C)CO)CCC(=O)N)CCC(=O)O)C(C)C