557766-14-0
BENZO[3,4]-18-NORANDROSTA-3,5-DIENE-3(2'H)-CARBOXYLIC ACID, 3',4',5',6'-TETRAHYDRO-17-(HYDROXYIMINO)-4',4',9,14-TETRAMETHYL-, METHYL ESTER, (3BETA,4BETA,8ALPHA,9BETA,10ALPHA,13ALPHA,14BETA)-
名称
BENZO[3,4]-18-NORANDROSTA-3,5-DIENE-3(2'H)-CARBOXYLIC ACID, 3',4',5',6'-TETRAHYDRO-17-(HYDROXYIMINO)-4',4',9,14-TETRAMETHYL-, METHYL ESTER, (3BETA,4BETA,8ALPHA,9BETA,10ALPHA,13ALPHA,14BETA)-
分子式
C28 H43 N O3
分子量
441.652
1基础信息
【名称】
BENZO[3,4]-18-NORANDROSTA-3,5-DIENE-3(2'H)-CARBOXYLIC ACID, 3',4',5',6'-TETRAHYDRO-17-(HYDROXYIMINO)-4',4',9,14-TETRAMETHYL-, METHYL ESTER, (3BETA,4BETA,8ALPHA,9BETA,10ALPHA,13ALPHA,14BETA)-
【CAS】
【MDL】
MFCD22665768
【中文同义词】
【英文同义词】
【分子式】
C28 H43 N O3
【分子量】
441.652
【Inchi】
InChI=1S/C28H43NO3/c1-24(2)13-15-28(23(30)32-6)16-14-26(4)18(20(28)17-24)7-8-22-25(3)11-10-21(29-31)19(25)9-12-27(22,26)5/h7,19-20,22,31H,8-17H2,1-6H3/b29-21+/t19-,20-,22+,25-,26+,27+,28-/m0/s1
【InChIKey】
InChIKey=UKXCLLYLCRBBDH-IIINPDGDSA-N
【SMILES】
CC1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]\5[C@@]4(CC/C5=N\O)C)C)[C@@H]2C1)C)C(=O)OC)C
【MOL File】
2化学和物理特性
【属性计算数值】
氢键供体数量:1
氢键受体数量:4
XLogP3:6.0
Bulk/Fine:F
3产品安全数据表
4CML 文件
BENZO[3,4]-18-NORANDROSTA-3,5-DIENE-3(2'H)-CARBOXYLIC ACID, 3',4',5',6'-TETRAHYDRO-17-(HYDROXYIMINO)-4',4',9,14-TETRAMETHYL-, METHYL ESTER, (3BETA,4BETA,8ALPHA,9BETA,10ALPHA,13ALPHA,14BETA)-.cml
快捷发布
1-PROPANONE, 2-METHYL-1-[(1R,3S)-1-METHYL-3-(1-METHYLETHENYL)CYCLOPENTYL]-
791620-50-3
CIS-1,5-DIMETHYLBICYCLO[3.3.0]OCTANE-3,7-DIONE
21170-10-5
(1S)-(2,5-DIMETHOXY-2,5-DIHYDROFURAN-2-YL)ETHANOL
236408-20-1
CAMPHANIC ACID
67111-66-4
2-(HYDROXYIMINO)-3-OXO-OLEAN-12-EN-28-OIC ACID
130216-67-0
3-OXO-OLEAN-12-EN-28-OIC ACID
17990-42-0
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1-PROPANONE, 2-METHYL-1-[(1R,3S)-1-METHYL-3-(1-METHYLETHENYL)CYCLOPENTYL]-
791620-50-3
CIS-1,5-DIMETHYLBICYCLO[3.3.0]OCTANE-3,7-DIONE
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(1S)-(2,5-DIMETHOXY-2,5-DIHYDROFURAN-2-YL)ETHANOL
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CAMPHANIC ACID
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2-(HYDROXYIMINO)-3-OXO-OLEAN-12-EN-28-OIC ACID
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3-OXO-OLEAN-12-EN-28-OIC ACID
17990-42-0