H2N-ISQAVHAAHAEINEA-OH_Chemical Cloud Database

H2N-ISQAVHAAHAEINEA-OH

Basic Information
Product Name：	H2N-ISQAVHAAHAEINEA-OH
English Synonyms：	H2N-ISQAVHAAHAEINEA-OH ; OVALBUMIN (324-338) [GALLUS GALLUS]/[COTURNIX COTURNIX]
MDL Number.：	MFCD08274369
H bond acceptor：	44
H bond donor：	23
Smile：	CC[C@H](C)[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)N
InChi：	InChI=1S/C66H105N21O23/c1-12-29(5)49(69)63(106)85-44(25-88)62(105)81-38(14-17-45(67)89)56(99)75-34(10)55(98)86-50(28(3)4)64(107)83-42(21-37-24-71-27-73-37)60(103)76-31(7)52(95)74-32(8)54(97)82-41(20-36-23-70-26-72-36)59(102)77-33(9)53(96)79-40(16-19-48(93)94)58(101)87-51(30(6)13-2)65(108)84-43(22-46(68)90)61(104)80-39(15-18-47(91)92)57(100)78-35(11)66(109)110/h23-24,26-35,38-44,49-51,88H,12-22,25,69H2,1-11H3,(H2,67,89)(H2,68,90)(H,70,72)(H,71,73)(H,74,95)(H,75,99)(H,76,103)(H,77,102)(H,78,100)(H,79,96)(H,80,104)(H,81,105)(H,82,97)(H,83,107)(H,84,108)(H,85,106)(H,86,98)(H,87,101)(H,91,92)(H,93,94)(H,109,110)/t29-,30-,31-,32-,33-,34-,35-,38-,39-,40-,41-,42-,43-,44-,49-,50-,51-/m0/s1
InChiKey：	InChIKey=CHRYAFISZKWIOS-ASPSQLKYSA-N

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