Aviptadil（CAS番号：40077-57-4）

Aviptadil

基本情報

編集器で閲覧

CAS番号

40077-57-4

分子式

C147H238N44O42S

分子量

3325.8 g/mol

EINECS

200-001-8

基本的な物理特性

密度

1.47±0.1 g/cm3(Predicted)

水溶性

Soluble to 1 mg/ml in water

SMILES

編集器で閲覧

CC[C@@H]([C@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CC1=CN=CN1)=O)CO)=O)CC(O)=O)=O)C)=O)C(C)C)=O)CC2=CC=CC=C2)=O)[C@H](O)C)=O)CC(O)=O)=O)CC(N)=O)=O)CC3=CC=C(O)C=C3)=O)[C@H](O)C)=O)CCCNC(N)=N)=O)CC(C)C)=O)CCCNC(N)=N)=O)CCCCN)=O)CCC(N)=O)=O)CCSC)=O)C)=O)C(C)C)=O)CCCCN)=O)CCCCN)=O)CC4=CC=C(O)C=C4)=O)CC(C)C)=O)CC(N)=O)=O)CO)=O)C(N[C@H](C(N[C@H](C(N)=O)CC(N)=O)=O)CC(C)C)=O)C

InChI

InChI=1S/C147H238N44O42S/c1-18-75(12)115(143(231)182-97(56-72(6)7)131(219)174-94(118(156)206)61-108(153)199)189-140(228)106(68-193)186-135(223)102(63-110(155)201)179-132(220)96(55-71(4)5)176-133(221)98(58-81-37-41-84(196)42-38-81)177-126(214)88(33-23-26-49-149)168-124(212)89(34-24-27-50-150)172-141(229)113(73(8)9)187-119(207)76(13)165-122(210)93(47-53-234-17)171-128(216)92(45-46-107(152)198)170-123(211)87(32-22-25-48-148)167-125(213)90(35-28-51-162-146(157)158)169-130(218)95(54-70(2)3)175-127(215)91(36-29-52-163-147(159)160)173-144(232)116(78(15)194)190-137(225)99(59-82-39-43-85(197)44-40-82)178-134(222)101(62-109(154)200)180-136(224)104(65-112(204)205)184-145(233)117(79(16)195)191-138(226)100(57-80-30-20-19-21-31-80)183-142(230)114(74(10)11)188-120(208)77(14)166-129(217)103(64-111(202)203)181-139(227)105(67-192)185-121(209)86(151)60-83-66-161-69-164-83/h19-21,30-31,37-44,66,69-79,86-106,113-117,192-197H,18,22-29,32-36,45-65,67-68,148-151H2,1-17H3,(H2,152,198)(H2,153,199)(H2,154,200)(H2,155,201)(H2,156,206)(H,161,164)(H,165,210)(H,166,217)(H,167,213)(H,168,212)(H,169,218)(H,170,211)(H,171,216)(H,172,229)(H,173,232)(H,174,219)(H,175,215)(H,176,221)(H,177,214)(H,178,222)(H,179,220)(H,180,224)(H,181,227)(H,182,231)(H,183,230)(H,184,233)(H,185,209)(H,186,223)(H,187,207)(H,188,208)(H,189,228)(H,190,225)(H,191,226)(H,202,203)(H,204,205)(H4,157,158,162)(H4,159,160,163)/t75-,76-,77-,78+,79+,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,113-,114-,115-,116-,117-/m0/s1

InChIKey

HEOYHMUESMJFDC-RIWXPGAOSA-N

LogP

4.02270

トポロジカル極性表面積

1453.6899999999996 Å²

水素結合ドナー/アクセプター

62 / 86

複雑度

7580

同義語と引用データ

英語

VASOACTIVE INTESTINAL PEPTIDE (HUMAN, BOVINE, PORCINE, RAT)
VASOACTIVE INTESTINAL PEPTIDE (HUMAN, PORCINE)
VASOACTIVE INTESTINAL PEPTIDE, HUMAN, PORCINE, AND RAT
VASOACTIVE INTESTINAL PEPTIDE (HUMAN, PORCINE) (BOVINE, RAT, CANINE)
VASOACTIVE INTESTINAL PEPTIDE HUMAN, PORCINE, RAT
VASOACTIVE INTESTINAL PEPTIDE, HUMAN, PORCINE, RAT, OVINE
VASOACTIVE INTESTINAL PEPTIDE, PORCINE
VASOACTIVE INTESTINAL PEPTIDE
Aviptadil
Vasoactive Intestinal Peptide
Vasoactive intestinal octacosapeptide
Vasoactive Intestinal Peptide human, porcine, rat
Aviptadil Acetate
Vasoactive intestinal octacosapeptide (swine) Protein Sequence Sequence Length: 28
Vasoactive Intestinal Peptide (human, rat, mouse, rabbit, canine, porcine)
VIP (human, mouse, rat)
VIP (human, rat, mouse, rabbit, canine, porcine)
VIP