Analyte Name

Norvancomycin Trifluoroacetic Acid Salt

Molecular Formula

C65H73Cl2N9O24 (free amine)

Molecular Weight

1435.23

SMILES

[H][C@@]([C@](NC([C@@](N)([H])CC(C)C)=O)([H])C1=O)(O)C(C=C2Cl)=CC=C2OC3=C(O[C@@H]4OC(CO)C(O)C(O)[C@H]4O[C@@H]5O[C@@H](C)[C@@H](O)[C@](N)(C)C5)C(OC6=CC=C([C@]7(O)[H])C=C6Cl)=CC([C@]([H])(C(NC8([H])C(N[C@]7([H])C(N[C@]([H])(C(O)=O)C(C=C(O)C=C9O)=C9C%10=C(O)C=CC8=C%10)=O)=O)=O)NC([C@@](CC(N)=O)([H])N1)=O)=C3

InChI

InChI=1S/C65H73Cl2N9O24/c1-22(2)11-33(68)57(87)75-48-50(82)25-6-9-37(31(66)13-25)96-39-15-27-16-40(54(39)100-64-55(53(85)52(84)41(21-77)98-64)99-43-20-65(4,70)56(86)23(3)95-43)97-38-10-7-26(14-32(38)67)51(83)49-62(92)74-47(63(93)94)30-17-28(78)18-36(80)44(30)29-12-24(5-8-35(29)79)45(59(89)76-49)73-60(90)46(27)72-58(88)34(19-42(69)81)71-61(48)91/h5-10,12-18,22-23,33-34,41,43,45-53,55-56,64,77-80,82-86H,11,19-21,68,70H2,1-4H3,(H2,69,81)(H,71,91)(H,72,88)(H,73,90)(H,74,92)(H,75,87)(H,76,89)(H,93,94)/t23-,33+,34-,41?,43-,45?,46+,47-,48+,49-,50+,51+,52?,53?,55+,56+,64-,65-/m0/s1

Alternate CAS Number

Free amine: 91700-98-0

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat