CAS: 93616-27-4 - Teicoplanin A 3-1

Formula:C₇₂H₆₈Cl₂N₈O₂₈

InChI:InChI=1S/C72H68Cl2N8O28/c1-24(85)76-55-60(93)58(91)47(22-83)108-71(55)110-63-28-5-9-42(37(74)15-28)106-46-18-30-17-45(57(46)90)105-41-8-2-25(10-36(41)73)11-38-64(96)78-52(29-12-31(86)19-33(13-29)104-43-16-26(3-7-40(43)89)50(75)65(97)77-38)67(99)80-53(30)68(100)79-51-27-4-6-39(88)34(14-27)49-35(54(70(102)103)81-69(101)56(63)82-66(51)98)20-32(87)21-44(49)107-72-62(95)61(94)59(92)48(23-84)109-72/h2-10,12-21,38,47-48,50-56,58-63,71-72,83-84,86-95H,11,22-23,75H2,1H3,(H,76,85)(H,77,97)(H,78,96)(H,79,100)(H,80,99)(H,81,101)(H,82,98)(H,102,103)/t38-,47+,48+,50+,51+,52+,53+,54-,55+,56-,58+,59+,60+,61-,62-,63+,71-,72-/m0/s1

InChI key:InChIKey=SUFIXUDUKRJOBH-QJXGWOFLSA-N

SMILES:O=C(O)C1NC(=O)C2NC(=O)C(NC(=O)C3NC(=O)C4NC(=O)C(NC(=O)C(N)C5=CC=C(O)C(OC6=CC(O)=CC4=C6)=C5)CC7=CC=C(OC=8C=C3C=C(OC9=CC=C(C=C9Cl)C2OC%10OC(CO)C(O)C(O)C%10NC(=O)C)C8O)C(Cl)=C7)C=%11C=CC(O)=C(C%11)C%12=C(OC%13OC(CO)C(O)C(O)C%13O)C=C(O)C=C%121