(4S,8R,9R,21R)-3,6,6,11,11,18,18,21-Octamethyl-5,7,10,12-tetraoxahexacyclo[14.5.1.0~1,8~.0~4,8~.0~9,14~.0~17,19~]docosa-2,14-dien-22-one（CAS号：77573-44-5）

巨大戟醇-3,4:5,20-双缩丙酮

基本信息

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CAS号

77573-44-5

分子式

C26H36O5

分子量

428.57 g/mol

化学分类

基础化工原料有机化学品羧酸类

基础化工原料有机化学品酮类

基础化工原料有机化学品醚类

基础化工原料有机化学品杂环化合物

医药化工医药中间体杂环中间体

精细化工产品表面活性剂阴离子表面活性剂

聚合物和塑料热塑性塑料聚烯烃

实验室化学品科研化学品生化试剂

基本物理性质

物理状态

Powder

密度

1.20±0.1 g/cm3 (20 ºC 760 Torr),

SMILES

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CC1CC2C(C2(C)C)C3C=C4COC(OC4C56C1(C3=O)C=C(C5OC(O6)(C)C)C)(C)C

InChI

InChI=1S/C26H36O5/c1-13-11-25-14(2)9-17-18(22(17,3)4)16(19(25)27)10-15-12-28-23(5,6)30-21(15)26(25)20(13)29-24(7,8)31-26/h10-11,14,16-18,20-21H,9,12H2,1-8H3/t14-,16?,17?,18?,20+,21-,25?,26-/m1/s1

InChIKey

JOKBBQPBIIZMJV-JQFFUGKZSA-N

LogP

4.411800000000004

拓扑极性表面积

53.99 Å²

氢键供体/受体

0 / 5

复杂度

941

安全信息

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储存条件

2-8℃

同义词与引用数据

英文

AKOS040760464
Ingenol-3,4:5,20-diacetonide
3,3,6,6,8,10,12,12-Octamethyl-10,11,11a,12,12a,13-hexahydro-1H,3H,4aH,6H,7aH-9a,13-methanocyclopropa[5,6][1,3]dioxolo[2',3']cyclopenta[1',2':9,10]cyclodeca[1,2-d][1,3]dioxin-15-one
HY-N0871
CS-3918
3,6,6,11,11,18,18,21-octamethyl-5,7,10,12-tetraoxahexacyclo[14.5.1.01,8.04,8.09,14.017,19]docosa-2,14-dien-22-one
BCP10724
10aH-2,12a-Methano-1H,4H-cyclopropa(5,6)(1,3)dioxolo(2',3')cyclopenta(1',2':9,10)cyclodeca(1,2-d)(1,3)dioxin-15-one, 1a,2,7a,13,14,14a-hexahydro-1,1,6,6,9,9,11,13-octamethyl-, (1aR-(1aalpha,2alpha,7aalpha,7bR*,10aalpha,12aalpha,13alpha,14aalpha))-
77573-44-5
FT-0696726
JOKBBQPBIIZMJV-UHFFFAOYSA-N
A865195
(1aR,7bR)-1aalpha,2,7aalpha,13,14,14aalpha-Hexahydro-1,1,6,6,9,9,11,13alpha-octamethyl-10aalphaH-2alpha,12aalpha-methano-1H,4H-cyclopropa[5,6][1,3]dioxolo[2',3']cyclopenta[1',2':9,10]cyclodeca[1,2-d][1,3]dioxin-15-one;Ingenol-3,4:5,20-diacetonide
Ingenol-3,4,5,20-diacetonide
DTXSID50998786
10aH-2,12a-Methano-1H,4H-cyclopropa[5,6][1,3]dioxolo[2',3']cyclopenta[1',2':9,10]cyclodeca[1,2-d][1,3]dioxin-15-one,1a,2,7a,13,14,14a-hexahydro-1,1,6,6,9,9,11,13-octamethyl-, [1aR-(1aa,2a,7aa,7bR*,10aa,12aa,13a,14aa)]- (9CI)
(1aR,7bR)-1aα,2,7aα,13,14,14aα-Hexahydro-1,1,6,6,9,9,11,13α-octamethyl-10aαH-2α,12aα-methano-1H,4H-cyclopropa[5,6][1,3]dioxolo[2',3']cyclopenta[1',2':9,10]cyclodeca[1,2-d][1,3]dioxin-15-one
Ingenol 3,4:5,20-bisacetonide
10aH-2,12a-Methano-1H,4H-cyclopropa(5,6)(1,3)dioxolo(2',3')cyclopenta(1',2':9,10)cyclodeca(1,2-d)(1,3)dioxin-15-one,1a,2,7a,13,14,14a-hexahydro-1,1,6,6,9,9,11,13-octamethyl-,(1aR-(1aalpha,2alpha,7aalpha,7bR*,10aalpha,12aalpha,13alpha,14aalpha))
3,3,6,6,8,10,12,12-octamethyl-10,11,11a,12,12a,13-hexahydro-1H,4aH,7aH-9a,13-methanocyclopropa[5,6][1,3]dioxolo[2',3']cyclopenta[1',2':9,10]cyclodeca[1,2-d][1,3]dioxin-15-one
(1S,16R,17S,19S)-3,6,6,11,11,18,18,21-Octamethyl-5,7,10,12-tetraoxahexacyclo[14.5.1.01,8.04,8.09,14.