化学式

CAS号

IUPAC Name

[(2R,3R,4R,5R,6R)-2-[[(1R,2S,3S,5R)-3-[(2R)-2-[[(4R)-4-氨基-4-carboxybutanoyl]氨基]-3-(carboxymethylamino)-3-氧代丙基]硫代-5-羟基-2-(2-羟基-7-甲氧基-5-甲基-4,6-二氢萘-1-羰基)氧基-5-[(4R)-2-氧代-1,3-二氧杂烷-4-基]-2,3-二氢-1H-s-二戊环并苯-1-基]氧基]-4,5-二羟基-6-methyloxan-3-基]-methylazanium [(2R,3R,4R,5R,6R)-2-[[(1R,2S,3S,5R)-3-[(2R)-2-[[(4R)-4-amino-4-carboxybutanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-5-hydroxy-2-(2-hydroxy-7-methoxy-5-methyl-4,6-dihydronaphthalene-1-carbonyl)oxy-5-[(4R)-2-oxo-1,3-dioxolan-4-yl]-2,3-dihydro-1H-s-indacen-1-yl]oxy]-4,5-dihydroxy-6-methyloxan-3-yl]-methylazanium

InChI

InChI=1S/C45H54N4O18S/c1-18-11-21(62-4)13-23-22(18)5-7-29(50)33(23)42(59)66-38-37(67-43-34(47-3)36(55)35(54)19(2)64-43)24-12-20-9-10-45(61,30-16-63-44(60)65-30)26(20)14-25(24)39(38)68-17-28(40(56)48-15-32(52)53)49-31(51)8-6-27(46)41(57)58/h7,9-10,12-14,19,27-28,30,34-39,43,47,50,54-55,61H,5-6,8,11,15-17,46H2,1-4H3,(H,48,56)(H,49,51)(H,52,53)(H,57,58)/p+1/t19-,27-,28+,30-,34-,35+,36-,37-,38+,39+,43-,45-/m1/s1

InChI Key

MZUWJQPQQUZPCJ-RKDHACFISA-O

Canonical SMILES

CC1C(C(C(C(O1)OC2C(C(C3=C2C=C4C=CC(C4=C3)(C5COC(=O)O5)O)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)OC(=O)C6=C7C=C(CC(=C7CC=C6O)C)OC)[NH2+]C)O)O

别名