化学式

CAS号

IUPAC Name

[(2R,3S,4S,5R,6S)-4-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-4-[(2S,3R,4R,5S,6R)-5-[[(3aS,4R,6S,7R,7aR)-7-羟基-2-氧代-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)-4-羟基-6-(苄氧基甲基)四氢吡喃-2-基]氧基-3,5-二乙酰-6-(苄氧基甲基)四氢吡喃-2-基]氧基-3-(benzenesulf [(2R,3S,4S,5R,6S)-4-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4S,5S,6R)-4-[(2S,3R,4R,5S,6R)-5-[[(3aS,4R,6S,7R,7aR)-7-hydroxy-2-oxo-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]oxy-3,5-diacetyloxy-6-(phenylmethoxymethyl)oxan-2-yl]oxy-3-(benzenesulfonamido)-4-hydroxy-6-(phenylmethoxymethyl)oxan-2-yl]oxy-5-acetyloxy-2-(phenylmethoxymethyl)-6-[[(2R,3S,4R)-4-phenylmethoxy-2-(phenylmethoxymethyl)-3,4-dihydro-2H-pyran-3-yl]oxy]oxan-3-yl] acetate

InChI

InChI=1S/C106H118N2O36S2/c1-65(109)129-94-83(63-125-56-73-40-22-9-23-41-73)136-104(138-90-78(128-58-75-44-26-11-27-45-75)50-51-127-79(90)59-121-52-69-32-14-5-15-33-69)99(131-67(3)111)97(94)141-102-86(108-146(119,120)77-48-30-13-31-49-77)88(114)92(81(134-102)61-123-54-71-36-18-7-19-37-71)140-105-100(132-68(4)112)98(95(130-66(2)110)84(137-105)64-126-57-74-42-24-10-25-43-74)142-101-85(107-145(117,118)76-46-28-12-29-47-76)87(113)91(80(133-101)60-122-53-70-34-16-6-17-35-70)139-103-89(115)96-93(143-106(116)144-96)82(135-103)62-124-55-72-38-20-8-21-39-72/h5-51,78-105,107-108,113-115H,52-64H2,1-4H3/t78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90+,91-,92-,93+,94+,95+,96-,97+,98+,99-,100-,101+,102+,103+,104+,105+/m1/s1

InChI Key

SNOAKMAMCPXHAA-VUCXZMHGSA-N

Canonical SMILES

CC(=O)OC1C(OC(C(C1OC2C(C(C(C(O2)COCC3=CC=CC=C3)OC4C(C(C(C(O4)COCC5=CC=CC=C5)OC(=O)C)OC6C(C(C(C(O6)COCC7=CC=CC=C7)OC8C(C9C(C(O8)COCC1=CC=CC=C1)OC(=O)O9)O)O)NS(=O)(=O)C1=CC=CC=C1)OC(=O)C)O)NS(=O)(=O)C1=CC=CC=C1)OC(=O)C)OC1C(C=COC1COCC1=CC=CC=C1)OCC1=CC=CC=C1)COCC1=CC=CC=C1

别名