Chemical Compound
[(2R,3aalpha,3 aalpha,7abeta,7 abeta)-7alpha-Hydroxy-7 beta-(2,4-dihydroxy-6-methylbenzoyloxy)octahydro-2,4 -spirobi[4H-1,3-dioxolo[4,5-c]pyran]-6beta-yl]2-O,6-O-dimethyl-4-O-[3-O-[(2R,3abeta)-4beta,6 beta,7aalpha-trimethyl-4 beta,7beta-dihydroxy-5 alpha-[3-O-(3-C,4-O-dimethyl-3-[N2,N6-bis(benzyloxycarbonyl)-L-lysylamino]-2,3,6-trideoxy-alpha-L-arabino-hexopyranosyl)-4-O-(2-methoxy-3,5-dichloro-4-hydroxy-6-methylbenzoyl)-2,6-dideoxy-beta-D-arabino-hexopyranosyl]octahydrospiro[4H-1,3-dioxolo[4,5-c]pyran-2,2 -[2H]pyran]-6beta-yl]-4-O-methyl-beta-D-fucopyranosyl]-beta-D-mannopyranoside
Primary record
[(2R,3aalpha,3 aalpha,7abeta,7 abeta)-7alpha-Hydroxy-7 beta-(2,4-dihydroxy-6-methylbenzoyloxy)octahydro-2,4 -spirobi[4H-1,3-dioxolo[4,5-c]pyran]-6beta-yl]2-O,6-O-dimethyl-4-O-[3-O-[(2R,3abeta)-4beta,6 beta,7aalpha-trimethyl-4 beta,7beta-dihydroxy-5 alpha-[3-O-(3-C,4-O-dimethyl-3-[N2,N6-bis(benzyloxycarbonyl)-L-lysylamino]-2,3,6-trideoxy-alpha-L-arabino-hexopyranosyl)-4-O-(2-methoxy-3,5-dichloro-4-hydroxy-6-methylbenzoyl)-2,6-dideoxy-beta-D-arabino-hexopyranosyl]octahydrospiro[4H-1,3-dioxolo[4,5-c]pyran-2,2 -[2H]pyran]-6beta-yl]-4-O-methyl-beta-D-fucopyranosyl]-beta-D-mannopyranoside
- 库存
- 550 克
- 纯度
- 98.1 %
化合物标识与属性
- PubChem CID
- 177482883
- SMILES
- CC1C(C(CC2(O1)OC3C(OC(C(C3(O2)C)O)OC4C(C(OC(C4OC)C)OC5C(OC(C(C5O)OC)OC6C(C7C(CO6)OC8(O7)C9C(C(CO8)OC(=O)C1=C(C=C(C=C1C)O)O)OCO9)O)COC)O)C)O)C1CC(C(C(O1)C)OC(=O)C1=C(C(=C(C(=C1OC)Cl)O)Cl)C)OC1CC(C(C(O1)C)OC)(C)NC(=O)C(CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)OCC1=CC=CC=C1
- Canonical SMILES
- COCC1OC(OC2OCC3OC4(OCC(OC(=O)c5c(C)cc(O)cc5O)C5OCOC54)OC3C2O)C(OC)C(O)C1OC1OC(C)C(OC)C(OC2OC(C)C3OC4(CC(O)C(C5CC(OC6CC(C)(NC(=O)C(CCCCNC(=O)OCc7ccccc7)NC(=O)OCc7ccccc7)C(OC)C(C)O6)C(OC(=O)c6c(C)c(Cl)c(O)c(Cl)c6OC)C(C)O5)C(C)O4)OC3(C)C2O)C1O
名称与同义词
- J1.096.898D
- [(2R,3aalpha,3 aalpha,7abeta,7 abeta)-7alpha-Hydroxy-7 beta-(2,4-dihydroxy-6-methylbenzoyloxy)octahydro-2,4 -spirobi[4H-1,3-dioxolo[4,5-c]pyran]-6beta-yl]2-O,6-O-dimethyl-4-O-[3-O-[(2R,3abeta)-4beta,6 beta,7aalpha-trimethyl-4 beta,7beta-dihydroxy-5 alpha-[3-O-(3-C,4-O-dimethyl-3-[N2,N6-bis(benzyloxycarbonyl)-L-lysylamino]-2,3,6-trideoxy-alpha-L-arabino-hexopyranosyl)-4-O-(2-methoxy-3,5-dichloro-4-hydroxy-6-methylbenzoyl)-2,6-dideoxy-beta-D-arabino-hexopyranosyl]octahydrospiro[4H-1,3-dioxolo[4,5-c]pyran-2,2 -[2H]pyran]-6beta-yl]-4-O-methyl-beta-D-fucopyranosyl]-beta-D-mannopyranoside
- 6-(6-{[2-({6-[7'-(2,4-dihydroxy-6-methylbenzoyloxy)-octahydro-2'H,3aH-2,4'-spirobi[[1,3]dioxolo[4,5-c]pyran]-7-oloxy]-4-hydroxy-5-methoxy-2-(methoxymethyl)oxan-3-yl}oxy)-3-hydroxy-5-methoxy-6-methyloxan-4-yl]oxy}-4',7-dihydroxy-4,6',7a-trimethyl-tetrahydro-3aH-spiro[[1,3]dioxolo[4,5-c]pyran-2,2'-oxan]-5'-yl)-4-{[4-(2,6-di{[(benzyloxy)carbonyl]amino}hexanamido)-5-methoxy-4,6-dimethyloxan-2-yl]oxy}-2-methyloxan-3-yl 3,5-dichloro-4-hydroxy-2-methoxy-6-methylbenzoate