SUBSTANCE P, [2-PRO-3,4-3H]-_ChemCD

SUBSTANCE P, [2-PRO-3,4-3H]-

basic_info
Product_Name：	SUBSTANCE P, [2-PRO-3,4-3H]-
EnglishSynonyms：	SUBSTANCE P, [2-PRO-3,4-3H]-
pro_mdlNumber：	MFCD00221676
pro_acceptors：	31
pro_donors：	16
pro_smile：	[3H]C1([3H])CN([C@H](C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O)C1([3H])[3H])C(=O)[C@@H](N)CCCNC(N)=N
InChi：	InChI=1S/C63H98N18O13S/c1-37(2)33-45(57(89)74-41(53(68)85)27-32-95-3)73-52(84)36-72-54(86)46(34-38-15-6-4-7-16-38)78-58(90)47(35-39-17-8-5-9-18-39)79-56(88)42(23-25-50(66)82)75-55(87)43(24-26-51(67)83)76-59(91)49-22-14-31-81(49)62(94)44(20-10-11-28-64)77-60(92)48-21-13-30-80(48)61(93)40(65)19-12-29-71-63(69)70/h4-9,15-18,37,40-49H,10-14,19-36,64-65H2,1-3H3,(H2,66,82)(H2,67,83)(H2,68,85)(H,72,86)(H,73,84)(H,74,89)(H,75,87)(H,76,91)(H,77,92)(H,78,90)(H,79,88)(H4,69,70,71)/t40-,41-,42-,43-,44-,45-,46-,47-,48-,49-/m0/s1/i13T2,21T2
InChiKey：	InChIKey=ADNPLDHMAVUMIW-NDBIZNBKSA-N

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