CAS Number
Molecular Formula
C65H73Cl2N9O24.HCl
Product format
Neat
Molecular Weight
1435.24 36.46
API Family
Synonyms
N2.1-demethylvancomycin B
Iupac Name
(1S, 2R, 18R, 19R, 22S, 25R, 28R, 40S)-48-[(2S, 3R, 4S, 5S, 6R)-3-[(2S, 4S, 5S, 6S)-4-amino-5-hydroxy-4, 6-dimethyloxan-2-yl]oxy-4, 5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-19-[[(2R)-2-amino-4-methylpentanoyl]amino]-22-(2-amino-2-oxoethyl)-5, 15-dichloro-2, 18, 32, 35, 37-pentahydroxy-20, 23, 26, 42, 44-pentaoxo-7, 13-dioxa-21, 24, 27, 41, 43-pentazaoctacyclo[26.14.2.23, 6.214, 17.18, 12.129, 33.010, 25.034, 39]pentaconta-3, 5, 8(48), 9, 11, 14, 16, 29(45), 30, 32, 34(39), 35, 37, 46 and 49-pentadecaene-40-carboxylic acid;hydrochloride
InChI
InChI=1S/C65H73Cl2N9O24.ClH/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);1H/t23-,33+,34-,41+,43-,45+,46+,47-,48+,49-,50+,51+,52+,53-,55+,56+,64-,65-;/m0./s1
