化学式

CAS号

IUPAC Name

[(2R,3S,4S,5R,6S)-4-[(2S,3R,4R,5S,6R)-4-[[(3aS,4R,6S,7R,7aS)-2-氧代-7-苄氧基-4-(苄氧基甲基)-4,6,7,7a-四氢-3aH-[1,3]二氧代[4,5-c]吡喃-6-基]氧基]-3-(benzenesulfonamido)-5-羟基-6-(苄氧基甲基)四氢吡喃-2-基]氧基-2-[[(2R,3R,4R,5S,6R)-5-[[(3aS,4R,6S,7R,7aS)-2-氧代-7-苄氧基-4-(苄氧基甲基)-4,6,7,7a-四氢-3aH-[ [(2R,3S,4S,5R,6S)-4-[(2S,3R,4R,5S,6R)-4-[[(3aS,4R,6S,7R,7aS)-2-oxo-7-phenylmethoxy-4-(phenylmethoxymethyl)-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-3-(benzenesulfonamido)-5-hydroxy-6-(phenylmethoxymethyl)oxan-2-yl]oxy-2-[[(2R,3R,4R,5S,6R)-5-[[(3aS,4R,6S,7R,7aS)-2-oxo-7-phenylmethoxy-4-(phenylmethoxymethyl)-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-3-(benzenesulfonamido)-4-hydroxy-6-(phenylmethoxymethyl)oxan-2-yl]oxymethyl]-5-phenylmethoxy-6-[[(2R,3S,4R)-4-phenylmethoxy-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran-3-yl]oxy]oxan-3-yl] acetate

InChI

InChI=1S/C115H122N2O34S2/c1-74(118)138-99-92(73-137-109-93(116-152(123,124)84-53-31-11-32-54-84)96(120)98(89(140-109)70-129-61-77-39-17-4-18-40-77)145-112-107(135-66-82-49-27-9-28-50-82)104-100(148-114(121)150-104)90(141-112)71-130-62-78-41-19-5-20-42-78)143-111(144-97-86(133-64-80-45-23-7-24-46-80)57-58-132-88(97)69-128-60-76-37-15-3-16-38-76)106(134-65-81-47-25-8-26-48-81)103(99)147-110-94(117-153(125,126)85-55-33-12-34-56-85)102(95(119)87(139-110)68-127-59-75-35-13-2-14-36-75)146-113-108(136-67-83-51-29-10-30-52-83)105-101(149-115(122)151-105)91(142-113)72-131-63-79-43-21-6-22-44-79/h2-58,86-113,116-117,119-120H,59-73H2,1H3/t86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97+,98-,99+,100+,101+,102-,103+,104+,105+,106-,107-,108-,109-,110+,111+,112+,113+/m1/s1

InChI Key

BCOKPMAUTUEDDK-NCFYNRGSSA-N

Canonical SMILES

CC(=O)OC1C(OC(C(C1OC2C(C(C(C(O2)COCC3=CC=CC=C3)O)OC4C(C5C(C(O4)COCC6=CC=CC=C6)OC(=O)O5)OCC7=CC=CC=C7)NS(=O)(=O)C8=CC=CC=C8)OCC9=CC=CC=C9)OC1C(C=COC1COCC1=CC=CC=C1)OCC1=CC=CC=C1)COC1C(C(C(C(O1)COCC1=CC=CC=C1)OC1C(C2C(C(O1)COCC1=CC=CC=C1)OC(=O)O2)OCC1=CC=CC=C1)O)NS(=O)(=O)C1=CC=CC=C1

别名