SMILES和InChIs
SMILES:
CC(C)C(NC(=O)C(CC(=O)N)NC(=O)C(CO)NC(=O)C(NC(=O)C(C)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCC(=O)N)NC(=O)C1CCCN1C(=O)C(CCCNC(=N)N)NC(=O)C(CCCCN)NC(=O)C(C)N)C(C)O)C(=O)NC(Cc1ccccc1)C(=O)NC(CO)C(=O)N
Canonical SMILES:
NCCCCC(C(=O)NC(C(=O)N1CCCC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N)CO)Cc1ccccc1)C(C)C)CC(=O)N)CO)C(O)C)C)CCCNC(=N)N)CCC(=O)N)CCCNC(=N)N)NC(=O)C(N)C
InChI:
InChI=1S/C62H105N23O18/c1-30(2)46(58(101)80-39(26-34-14-7-6-8-15-34)54(97)81-41(28-86)48(67)91)83-55(98)40(27-45(66)90)79-56(99)42(29-87)82-59(102)47(33(5)88)84-50(93)32(4)74-51(94)36(17-11-23-72-61(68)69)76-53(96)37(20-21-44(65)89)77-57(100)43-19-13-25-85(43)60(103)38(18-12-24-73-62(70)71)78-52(95)35(16-9-10-22-63)75-49(92)31(3)64/h6-8,14-15,30-33,35-43,46-47,86-88H,9-13,16-29,63-64H2,1-5H3,(H2,65,89)(H2,66,90)(H2,67,91)(H,74,94)(H,75,92)(H,76,96)(H,77,100)(H,78,95)(H,79,99)(H,80,101)(H,81,97)(H,82,102)(H,83,98)(H,84,93)(H4,68,69,72)(H4,70,71,73)
InChIKey:
RLOKBRYNMGQKKD-UHFFFAOYSA-N