Machiline (BioDeep_00000000890)

PANOMIX_OTCML-2023

代谢物信息卡片

7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-, (1R)-

化学式: C17H19NO3 (285.13648639999997)
中文名称: (+)-乌药碱, 乌药碱
谱图信息: 最多检出来源 Viridiplantae(plant) 4.35%

分子结构信息

SMILES: COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O
InChI: InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3

描述信息

(R)-coclaurine is a coclaurine. It is an enantiomer of a (S)-coclaurine.
(R)-Coclaurine is a natural product found in Mezilaurus synandra, Stephania excentrica, and other organisms with data available.

同义名列表

23 个代谢物同义名

Machiline; 7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-, (1R)-; 6-Methoxy-7-hydroxy-(1R)-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline; 7-Isoquinolinol, 1,2,3,4-tetrahydro-1-((4-hydroxyphenyl)methyl)-6-methoxy-, (R)-; 7-ISOQUINOLINOL,1,2,3,4-TETRAHYDRO-1-[(4-HYDROXYPHENYL)METHYL]-6-METHOXY-, (1R)-; (1R)-1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol; (R)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-7-isoquinolinol; (1R)-1-(4-hydroxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol; (+)-1(R)-Coclaurine; (+)-1R-Cocluaurine; (+)-(R)-Coclaurine; (R)-(+)-coclaurine; (R)-d-Coclaurine; (+)-R-Coclaurine; (R)-Coclaurine; (+)-Coclaurine; Sanjoinine K; d-Coclaurine; CHEBI:27482; AIDS-226939; AIDS226939; 2196-60-3; C06349

数据库引用编号

19 个数据库交叉引用编号

ChEBI: CHEBI:18417
ChEBI: CHEBI:27482
KEGG: C06348
KEGG: C06349
PubChem: 281691
PubChem: 440989
ChEMBL: CHEMBL453291
ChEMBL: CHEMBL256448
ChemIDplus: 0002196603
CAS: 15548-30-8
CAS: 2196-60-3
medchemexpress: HY-N2550
MetaboLights: MTBLC27482
PubChem: 8584
KNApSAcK: C00047850
NIKKAJI: J6.009G
PubChem: 8585
KNApSAcK: C00025652
NIKKAJI: J36.682J

分类词条

代谢反应

0 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(0)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

40 个相关的物种来源信息

203270 - Berberis aquifolium: 10.1016/J.CHROMA.2015.08.015
13601 - Berberis bealei: 10.1016/J.CHROMA.2015.08.015
39279 - Bongardia chrysogonum: 10.1021/NP50064A024
46963 - Caulophyllum thalictroides: 10.1016/J.JPBA.2011.07.028
461574 - Cocculus diversifolius: 10.1016/0040-4020(80)88040-9
421226 - Cocculus hirsutus: 10.1016/0040-4020(80)88040-9
527501 - Cocculus pendulus: 10.1016/0040-4020(75)80272-9
3442 - Coptis japonica: 10.1074/JBC.M705082200
3463 - Corydalis: 10.1007/BF00564963
152372 - Cyclea: 10.1021/NP50101A020
152373 - Cyclea barbata:
152373 - Cyclea barbata: 10.1021/NP50101A020
2893873 - Cyclea peltata:
2893873 - Cyclea peltata: 10.1021/NP50063A032
1127147 - Delphinium caeruleum: 10.1016/J.PHYTOCHEM.2004.03.017
262935 - Discaria pubescens: 10.1055/S-2007-969767
49817 - Erythrina crista-galli: 10.1016/0040-4020(80)80108-6
325535 - Machilus japonica: 10.1021/NP9000653
1679399 - Machilus minutiflora: 10.1021/NP9000653
56857 - Macleaya cordata: 10.1016/J.MOLP.2017.05.007
86725 - Magnolia biondii: 10.1055/S-2007-969876
349509 - Magnolia obovata: 10.1093/CHROMSCI/BMW052
3411 - Magnolia salicifolia: 10.1055/S-2007-969876
1354000 - Mezilaurus synandra: 10.1016/S0031-9422(00)86983-6
1310093 - Monoon borneense: 10.1021/NP900207Z
4432 - Nelumbo nucifera: 10.1016/J.BMC.2004.10.020
1504475 - Phaeanthus ophthalmicus: 10.1021/NP900207Z
1504478 - Polyalthia macropoda: 10.1021/NP900207Z
152363 - Sinomenium acutum: 10.1016/0040-4020(80)88040-9
152367 - Stephania cephalantha:
152367 - Stephania cephalantha: 10.1021/NP50064A031
1501462 - Stephania excentrica:
152366 - Stephania hernandifolia:
461633 - Stephania japonica:
1924984 - Stephania pierrei: 10.1021/NP960381N
425106 - Stephania tetrandra:
295132 - Trepobates: 10.1021/NP960381N
992813 - Xylopia parviflora: 10.1016/J.PHYTOCHEM.2006.07.011
33090 - 苦杏仁: -
33090 - 荷叶: -

在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：

PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。

点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。

文献列表

Isabel Desgagné-Penix, Morgan F Khan, David C Schriemer, Dustin Cram, Jacek Nowak, Peter J Facchini. Integration of deep transcriptome and proteome analyses reveals the components of alkaloid metabolism in opium poppy cell cultures. BMC plant biology. 2010 Nov; 10(?):252. doi: 10.1186/1471-2229-10-252. [PMID: 21083930]
Kuo-Hsiung Lee. Discovery and development of natural product-derived chemotherapeutic agents based on a medicinal chemistry approach. Journal of natural products. 2010 Mar; 73(3):500-16. doi: 10.1021/np900821e. [PMID: 20187635]
Pi Cheng, Ning Huang, Zhi-Yong Jiang, Quan Zhang, Yong-Tang Zheng, Ji-Jun Chen, Xue-Mei Zhang, Yun-Bao Ma. 1-Aryl-tetrahydroisoquinoline analogs as active anti-HIV agents in vitro. Bioorganic & medicinal chemistry letters. 2008 Apr; 18(7):2475-8. doi: 10.1016/j.bmcl.2008.02.040. [PMID: 18316190]
Ihsan Ergün, M Cenk Akbostanci, Başol Canbakan, Bilge Koçer, Arzu Ensari, Gökhan Nergizoglu, Kenan Keven. Minimal change nephrotic syndrome with stiff-person syndrome: is there a link?. American journal of kidney diseases : the official journal of the National Kidney Foundation. 2005 Jul; 46(1):e11-4. doi: 10.1053/j.ajkd.2005.03.009. [PMID: 15983949]
Yoshiki Kashiwada, Akihiro Aoshima, Yasumasa Ikeshiro, Yuh-Pan Chen, Hiroshi Furukawa, Masataka Itoigawa, Toshihiro Fujioka, Kunihide Mihashi, L Mark Cosentino, Susan L Morris-Natschke, Kuo-Hsiung Lee. Anti-HIV benzylisoquinoline alkaloids and flavonoids from the leaves of Nelumbo nucifera, and structure-activity correlations with related alkaloids. Bioorganic & medicinal chemistry. 2005 Jan; 13(2):443-8. doi: 10.1016/j.bmc.2004.10.020. [PMID: 15598565]
Jürgen Schmidt, Klaus Raith, Chotima Boettcher, Meinhart H Zenk. Analysis of benzylisoquinoline-type alkaloids by electrospray tandem mass spectrometry and atmospheric pressure photoionization. European journal of mass spectrometry (Chichester, England). 2005; 11(3):325-33. doi: 10.1255/ejms.745. [PMID: 16107747]