VASOACTIVE INTESTINAL POLYPEPTIDE[125I]

CAS号
CCD编号
CCD00107195
分子式
C147 H236 I2 N44 O42 S
分子量
3573.81

基本信息

产品名称: VASOACTIVE INTESTINAL POLYPEPTIDE[125I]
英文同义词: VASOACTIVE INTESTINAL POLYPEPTIDE[125I]
MDL号: MFCD00236203
氢键受体数量: 86
氢键供体数量: 51
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](Cc1ccc(c(c1)[125I])O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(c(c2)[125I])O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](Cc3ccccc3)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4c[nH]cn4)N
InChi: InChI=1S/C147H236I2N44O42S/c1-18-73(12)115(143(233)184-95(52-70(6)7)131(221)176-92(118(158)208)59-108(155)201)191-140(230)104(66-195)188-135(225)100(61-110(157)203)181-132(222)94(51-69(4)5)178-133(223)97(56-79-37-40-105(198)82(148)53-79)179-126(216)86(33-23-26-45-151)170-124(214)87(34-24-27-46-152)174-141(231)113(71(8)9)189-119(209)74(13)167-122(212)91(43-49-236-17)173-128(218)90(39-42-107(154)200)172-123(213)85(32-22-25-44-150)169-125(215)88(35-28-47-164-146(159)160)171-130(220)93(50-68(2)3)177-127(217)89(36-29-48-165-147(161)162)175-144(234)116(76(15)196)192-138(228)98(57-80-38-41-106(199)83(149)54-80)180-134(224)99(60-109(156)202)182-136(226)102(63-112(206)207)186-145(235)117(77(16)197)193-137(227)96(55-78-30-20-19-21-31-78)185-142(232)114(72(10)11)190-120(210)75(14)168-129(219)101(62-111(204)205)183-139(229)103(65-194)187-121(211)84(153)58-81-64-163-67-166-81/h19-21,30-31,37-38,40-41,53-54,64,67-77,84-104,113-117,194-199H,18,22-29,32-36,39,42-52,55-63,65-66,150-153H2,1-17H3,(H2,154,200)(H2,155,201)(H2,156,202)(H2,157,203)(H2,158,208)(H,163,166)(H,167,212)(H,168,219)(H,169,215)(H,170,214)(H,171,220)(H,172,213)(H,173,218)(H,174,231)(H,175,234)(H,176,221)(H,177,217)(H,178,223)(H,179,216)(H,180,224)(H,181,222)(H,182,226)(H,183,229)(H,184,233)(H,185,232)(H,186,235)(H,187,211)(H,188,225)(H,189,209)(H,190,210)(H,191,230)(H,192,228)(H,193,227)(H,204,205)(H,206,207)(H4,159,160,164)(H4,161,162,165)/t73-,74-,75-,76+,77+,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96+,97+,98-,99-,100-,101-,102-,103-,104-,113-,114-,115-,116-,117-/m0/s1/i148-2,149-2
InChiKey: InChIKey=MWSJQVALGKVQRP-SDWOUOGGSA-N

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