ADRENOMEDULLIN (26-52) (HUMAN)

CAS号
CCD编号
CCD00562939
分子式
C139 H216 N40 O42
分子量
3119.47

基本信息

产品名称: ADRENOMEDULLIN (26-52) (HUMAN)
英文同义词: LEU-ALA-HIS-GLN-ILE-TYR-GLN-PHE-THR-ASP-LYS-ASP-LYS-ASP-ASN-VAL-ALA-PRO-ARG-SER-LYS-ILE-SER-PRO-GLN-GLY-TYR-NH2 ; ADRENOMEDULLIN (26-52) (HUMAN) ; H-LEU-ALA-HIS-GLN-ILE-TYR-GLN-PHE-THR-ASP-LYS-ASP-LYS-ASP-ASN-VAL-ALA-PRO-ARG-SER-LYS-ILE-SER-PRO-GLN-GLY-TYR-NH2 ; LAHQIYQFTDKDKDNVAPRSKISPQGY-NH2
MDL号: MFCD06797304
氢键受体数量: 82
氢键供体数量: 45
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)N[C@@H](Cc5ccc(cc5)O)C(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc6c[nH]cn6)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N
InChi: InChI=1S/C139H216N40O42/c1-12-70(7)110(176-122(205)88(44-47-103(146)187)162-124(207)92(58-78-63-151-67-154-78)165-114(197)72(9)155-115(198)81(143)54-68(3)4)134(217)170-90(57-77-36-40-80(184)41-37-77)123(206)161-87(43-46-102(145)186)120(203)166-91(56-75-26-15-14-16-27-75)128(211)177-112(74(11)182)136(219)171-96(62-108(194)195)126(209)159-83(29-18-21-49-141)117(200)168-94(60-106(190)191)125(208)158-82(28-17-20-48-140)118(201)169-95(61-107(192)193)127(210)167-93(59-104(147)188)129(212)174-109(69(5)6)133(216)156-73(10)137(220)178-52-24-32-99(178)131(214)163-85(31-23-51-152-139(149)150)119(202)172-97(65-180)130(213)160-84(30-19-22-50-142)121(204)175-111(71(8)13-2)135(218)173-98(66-181)138(221)179-53-25-33-100(179)132(215)164-86(42-45-101(144)185)116(199)153-64-105(189)157-89(113(148)196)55-76-34-38-79(183)39-35-76/h14-16,26-27,34-41,63,67-74,81-100,109-112,180-184H,12-13,17-25,28-33,42-62,64-66,140-143H2,1-11H3,(H2,144,185)(H2,145,186)(H2,146,187)(H2,147,188)(H2,148,196)(H,151,154)(H,153,199)(H,155,198)(H,156,216)(H,157,189)(H,158,208)(H,159,209)(H,160,213)(H,161,206)(H,162,207)(H,163,214)(H,164,215)(H,165,197)(H,166,203)(H,167,210)(H,168,200)(H,169,201)(H,170,217)(H,171,219)(H,172,202)(H,173,218)(H,174,212)(H,175,204)(H,176,205)(H,177,211)(H,190,191)(H,192,193)(H,194,195)(H4,149,150,152)/t70-,71-,72-,73-,74+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,109-,110-,111-,112-/m0/s1
InChiKey: InChIKey=ZNDPBPXKRJSRCS-DYJUZTNOSA-N

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