(4aS,6aS,6bR,8aR,9R,10S,12aR,12bR,14bS)-(2S,3R,4S,5S,6R)-3,4,5-三羟基-6-((((2S,3R,4S,5R)-3,4,5-三羟基四氢-2H-吡喃-2-氧基))甲基)四氢-2H-吡喃-2-基 10-(((2S,3R,4S,5S)-3-(((2S,3R,4R,5S,6S)-3,5-二羟基-6-甲基-4-(((2S,3R,4S,5R)-3,4,5-三羟基四氢-2H-吡喃-2-氧基))四氢-2H-吡喃-2-氧基))-4,5-二羟基四氢-2H-吡喃-2-氧基))-9-(羟甲基)-2,2,6a,6b,9,12a-六甲基-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-二十氢苉-4a-甲酸酯

6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl (3β,4α)-23-hydroxy-3-[(O-β-D-xylopyranosyl-(1→3)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl)oxy]olean-12-en-28-oate (ACI)

产品编号 : KL-1021184-779

Cas No. : 1021184-77-9

标准英文名 : (4aS,6aS,6bR,8aR,9R,10S,12aR,12bR,14bS)-(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl 10-(((2S,3R,4S,5S)-3-(((2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-4,5-dihydroxytetrahydro-2H-pyran-2-yl)oxy)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate

分子式 : C₅₇H₉₂O₂₅

分子量 : 1,177.34

MDL No. :

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6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl (3β,4α)-23-hydroxy-3-[(O-β-D-xylopyranosyl-(1→3)-O-6-deoxy-α-L-mannopyranosyl-(1→2)-α-L-arabinopyranosyl)oxy]olean-12-en-28-oate (ACI)

GHS
Smiles	C([C@]12CCC(C)(C)C[C@@]1([H])C1[C@]([C@@]3(CC[C@@]4([H])[C@]([C@H](CC[C@]4(C)[C@@]3([H])CC=1)O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]1O)(C)CO)C)(CC2)C)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)O1
Inchi	InChI=1S/C57H92O25/c1-24-34(62)44(80-47-41(69)36(64)28(60)20-74-47)43(71)49(77-24)81-45-37(65)29(61)21-75-50(45)79-33-11-12-53(4)31(54(33,5)23-58)10-13-56(7)32(53)9-8-25-26-18-52(2,3)14-16-57(26,17-15-55(25,56)6)51(72)82-48-42(70)39(67)38(66)30(78-48)22-76-46-40(68)35(63)27(59)19-73-46/h8,24,26-50,58-71H,9-23H2,1-7H3/t24-,26-,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37-,38+,39-,40+,41+,42+,43+,44+,45+,46-,47-,48-,49-,50-,53-,54-,55+,56+,57-/m0/s1
InchiKey	BTUYGUFIIUIODG-IUEFZHLPSA-N
别名
性状
存储条件
熔点
闪点
化学稳定性
沸点
密度
海关编码
手性
生物活性
理化性质
UN No.
特性
用途
蒸气压
运输要求
品牌

GHS

Smiles

C([C@]12CCC(C)(C)C[C@@]1([H])C1[C@]([C@@]3(CC[C@@]4([H])[C@]([C@H](CC[C@]4(C)[C@@]3([H])CC=1)O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@H]1O)(C)CO)C)(CC2)C)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)O1

Inchi

InChI=1S/C57H92O25/c1-24-34(62)44(80-47-41(69)36(64)28(60)20-74-47)43(71)49(77-24)81-45-37(65)29(61)21-75-50(45)79-33-11-12-53(4)31(54(33,5)23-58)10-13-56(7)32(53)9-8-25-26-18-52(2,3)14-16-57(26,17-15-55(25,56)6)51(72)82-48-42(70)39(67)38(66)30(78-48)22-76-46-40(68)35(63)27(59)19-73-46/h8,24,26-50,58-71H,9-23H2,1-7H3/t24-,26-,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37-,38+,39-,40+,41+,42+,43+,44+,45+,46-,47-,48-,49-,50-,53-,54-,55+,56+,57-/m0/s1

InchiKey

BTUYGUFIIUIODG-IUEFZHLPSA-N

别名

性状

存储条件

熔点

闪点

化学稳定性

沸点

密度

海关编码

手性