乌发醇 | 545-46-0
中文名称:
乌发醇
英文名称:
Uvaol
CAS No.:
545-46-0
分子式:
C3 0 H5 0 O2
分子量:
442.7168
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:乌发醇结构式
简介
乌发醇是一种化学物质,化学式是C30H50O2。
名称和标识符
MDL
MFCD00009620
InChIKey
XUARCIYIVXVTAE-ZAPOICBTSA-N
Inchi
1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1
SMILES
O([H])[C@@]1([H])C([H])([H])C([H])([H])[C@@]2(C([H])([H])[H])[C@]([H])(C1(C([H])([H])[H])C([H])([H])[H])C([H])([H])C([H])([H])[C@@]1(C([H])([H])[H])[C@]3(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]4(C([H])([H])O[H])C([H])([H])C([H])([H])[C@@]([H])(C([H])([H])[H])[C@]([H])(C([H])([H])[H])[C@@]4([H])C3=C([H])C([H])([H])[C@@]12[H]
别名信息
- 中文别名 -
[
"Urs-12-ene-3β,28-diol",
" 乌苏醇"
]
- 英文别名 -
Uvaol
12-Ursen-3-beta,28-diol
UVAOL(AS)
Uvaolneat
12-URSEN-3B,28-DIOL
12-URSEN-3BETA,28 DIOL
3B,28-DIHYDROXY-URSA-12-EN
urs-12-ene-3,28-diol
urs-12-ene-3beta,28-diol
Uvaol,Urs-12-ene-3,28-diol
Urs-12-ene-3β,28-diol
W599R31ROT
Uvaol, >=95%
BCBcMAP01_000233
(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14bR)-8a-Hydroxymethyl-4
Urs-12-ene-3,28-diol
Q27136369
MFCD00009620
(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol
SMP1_000309
CS-0016397
(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14bR)-8a-Hydroxymethyl-4,4,6a,6b,11,12,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-eicosahydro-picen-3-ol
(3.beta.)-Urs-12-ene-3,28-diol
Urs-12-ene-3,28-diol, (3.beta.)
3,28-DIHYDROXYURS-12-ENE
s9551
Urs-12-ene-3,28-diol, (3.beta.)-
SCHEMBL337913
SR-05000002219-2
NSC 159627
AS-84026
3.BETA.,28-DIHYDROXYURS-12-ENE
SR-05000002219
URS-12-ENE-3.BETA.,28-DIOL
3-beta,28-Dihydroxy-urs-12-ene
NS00043850
(3beta)-Urs-12-ene-3,28-diol
CHEMBL399873
BDBM50218196
AKOS016036269
URS-12-EN-3.BETA.,28-DIOL
UNII-W599R31ROT
1ST001408
CHEBI:67894
EINECS 208-888-3
Urs-12-ene-3,28-diol, (3b)-
(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-ol
Urs-12-ene-3beta,28-diol
HY-N1109
545-46-0
NSC-159627
UVALOL
Uvaol (AS)
NSC159627
SCHEMBL19858821
(3R,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol
E80760
Uvalol
3beta,28-Dihydroxyurs-12-ene
ConMedNP.2743
物化性质
实验特性
LogP
6.99720
PSA
40.46000
折射率
1.549
沸点
523.70°C.@760.00mmHg(est)
熔点
223-225 °C (lit.)
蒸气压
0.0±3.1 mmHg at 25°C
闪点
211.6±24.7 °C
溶解度
0.0002014 mg/L @ 25 °C (est)
颜色与性状
Powder
溶解性
未确定
密度
1.1±0.1 g/cm3
计算特性
精确分子量
442.38100
氢键供体数量
2
氢键受体数量
2
可旋转化学键数量
1
同位素质量
442.381080833 g/mol
重原子数量
32
复杂度
799
同位素原子数量
0
确定原子立构中心数量
10
不确定原子立构中心数量
0
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
7.4
表面电荷
0
拓扑分子极性表面积
40.5
分子量
442.7
相关文献
1.
A highly automated method for simultaneous determination of sterols, erythrodiol and uvaol in olive oils
Qiang Gu,Xiaojuan Yi,Jinling Shen,Jing Shi,Yijun Liu,Jingdong Shao Anal. Methods 2016 8 4022
2.
The differential localization of a methyl group confers a different anti-breast cancer activity to two triterpenes present in olives
Cristina Sánchez-Quesada,Alicia López-Biedma,José J. Gaforio Food Funct. 2015 6 248
3.
A facile method for simultaneous analysis of phytosterols, erythrodiol, uvaol, tocopherols and lutein in olive oils by LC-MS
Qiang Gu,Xiaojuan Yi,Zhaohui Zhang,Hua Yan,Jing Shi,Hui Zhang,Yue Wang,Jingdong Shao Anal. Methods 2016 8 1373
4.
Success stories of natural product-derived compounds from plants as multidrug resistance modulators in microorganisms
Xiaohan Zhai,Guoyu Wu,Xufeng Tao,Shilei Yang,Linlin Lv,Yanna Zhu,Deshi Dong,Hong Xiang RSC Adv. 2023 13 7798
5.
Natural products as modulators of retinoic acid receptor-related orphan receptors (RORs)
Angela Ladurner,Patrik F. Schwarz,Verena M. Dirsch Nat. Prod. Rep. 2021 38 757
6.
Biological effects of the olive tree and its derivatives on the skin
Lucía Melguizo-Rodríguez,Anabel González-Acedo,Rebeca Illescas-Montes,Enrique García-Recio,Javier Ramos-Torrecillas,Victor J. Costela-Ruiz,Olga García-Martínez Food Funct. 2022 13 11410
7.
Fruits and their phytochemicals in mitigating the ill effects of ionizing radiation: review on the existing scientific evidence and way forward
Shamprasad Varija Raghu,Suresh Rao,Venkataramana Kini,Avinash Kundadka Kudva,Thomas George,Manjeshwar Shrinath Baliga Food Funct. 2023 14 1290
8.
The composition of potentially bioactive triterpenoid glycosides in red raspberry is influenced by tissue, extraction procedure and genotype
Gordon J. McDougall,J. William Allwood,Gema Pereira-Caro,Emma M. Brown,Cheryl Latimer,Gary Dobson,Derek Stewart,Nigel G. Ternan,Roger Lawther,Gloria O'Connor,Ian Rowland,Alan Crozier,Chris I. R. Gill Food Funct. 2017 8 3469
9.
Olive oil and postprandial hyperlipidemia: implications for atherosclerosis and metabolic syndrome
Sergio Montserrat-de la Paz,Beatriz Bermudez,Magdalena P. Cardelo,Sergio Lopez,Rocio Abia,Francisco J. G. Muriana Food Funct. 2016 7 4734
10.
Synthesis, biology and clinical significance of pentacyclic triterpenes: a multi-target approach to prevention and treatment of metabolic and vascular diseases
Huaming Sheng,Hongbin Sun Nat. Prod. Rep. 2011 28 543
乌发醇推荐生产厂家
乌发醇标准品|对照品
手机:13657291602
电话:027-59223056
联系人:郭经理
QQ:1098480033
乌发醇
手机:13348961525
联系人:杨洋
QQ:2851167780
熊果醇
手机:18788556290
电话:+86-871-65217109
联系人:郑经理
QQ:1477035482
熊果醇
手机:19160369126
电话:028-85142057
联系人:杨经理
QQ:3005358466
乌发醇
手机:18018507602
联系人:刘经理
QQ:394643792
960化工网为您提供乌发醇专业化合物百科信息,包括中文名,英文名,分子式,分子量,以及该化合物的CasNo.:545-46-0,和相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等