化学式

CAS号

IUPAC Name

丙-2-烯基(2S,3R)-2-[[(2S)-2-[[(2S)-4-[[(2R,3R,4R,5S,6R)-4-[[(3aS,4R,6R,7R,7aS)-7-乙酰氧基-4-(羟甲基)-2-氧代-4,6,7,7a-四氢-3aH-[1,3]二氧代[4,5-c]吡喃-6-基]氧基]-3-乙酰氨基-5-乙酰氧基-6-(羟甲基)四氢吡喃-2-基]氨基]-2-[[(2S)-4-甲基-2-[[(2S)-2-(苄氧基羰基氨基)丙酰基]氨基]丁酰基]氨基]-4-oxobutanoyl]氨基]-4-methylpentanoy prop-2-enyl (2S,3R)-2-[[(2S)-2-[[(2S)-4-[[(2R,3R,4R,5S,6R)-4-[[(3aS,4R,6R,7R,7aS)-7-acetyloxy-4-(hydroxymethyl)-2-oxo-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-3-acetamido-5-acetyloxy-6-(hydroxymethyl)oxan-2-yl]amino]-2-[[(2S)-4-methyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylmethoxybutanoate

InChI

InChI=1S/C60H83N7O23/c1-11-22-81-57(78)45(33(7)82-28-37-18-14-12-15-19-37)67-55(77)40(24-31(4)5)64-54(76)41(65-53(75)39(23-30(2)3)63-52(74)32(6)61-59(79)83-29-38-20-16-13-17-21-38)25-44(73)66-56-46(62-34(8)70)49(47(84-35(9)71)42(26-68)86-56)88-58-51(85-36(10)72)50-48(43(27-69)87-58)89-60(80)90-50/h11-21,30-33,39-43,45-51,56,58,68-69H,1,22-29H2,2-10H3,(H,61,79)(H,62,70)(H,63,74)(H,64,76)(H,65,75)(H,66,73)(H,67,77)/t32-,33+,39-,40-,41-,42+,43+,45-,46+,47+,48-,49+,50-,51+,56+,58-/m0/s1

InChI Key

HNBCECYIXGFXMN-NAPWMHKJSA-N

Canonical SMILES

CC(C)CC(C(=O)NC(CC(=O)NC1C(C(C(C(O1)CO)OC(=O)C)OC2C(C3C(C(O2)CO)OC(=O)O3)OC(=O)C)NC(=O)C)C(=O)NC(CC(C)C)C(=O)NC(C(C)OCC4=CC=CC=C4)C(=O)OCC=C)NC(=O)C(C)NC(=O)OCC5=CC=CC=C5

别名