MOROL (BioDeep_00000000657)

PANOMIX_OTCML-2023

代谢物信息卡片

(3S,4aR,6aR,6bR,8aR,12bR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-Octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12b,13,14,14a,14b-eicosahydro-picen-3-ol

化学式: C30H50O (426.386145)
中文名称:
谱图信息: 最多检出来源 Chinese Herbal Medicine(otcml) 7.81%

分子结构信息

SMILES: CC1(C)C=C2C3CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)CC1
InChI: InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h19-20,22-24,31H,9-18H2,1-8H3/t20-,22+,23-,24+,27-,28+,29-,30-/m1/s1

描述信息

Germanicol is a pentacyclic triterpenoid that is oleanane substituted by a hydroxy group at the 3beta-position and with a double bond between positioins 18 and 19. It is a pentacyclic triterpenoid and a secondary alcohol. It derives from a hydride of an oleanane.
Germanicol is a natural product found in Barringtonia racemosa, Euphorbia nicaeensis, and other organisms with data available.

同义名列表

15 个代谢物同义名

(3S,4aR,6aR,6bR,8aR,12bR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-Octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12b,13,14,14a,14b-eicosahydro-picen-3-ol; (3S,4aR,6aS,6aR,6bR,8aR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,6a,7,8,9,10,13,14,14a-tetradecahydropicen-3-ol; OLEAN-18-EN-3-OL, (3.BETA.)-; 5alpha-olean-18-en-3beta-ol; (3.BETA.)-OLEAN-18-EN-3-OL; Olean-18-en-3-ol, (3beta)-; (3beta)-olean-18-en-3-ol; OLEAN-18-EN-3.BETA.-OL; olean-18-en-3beta-ol; Olean-18-en-3-ol; UNII-7NEX9512DZ; Germanicol; 7NEX9512DZ; MOROL; Olean-18-en-3-ol #

数据库引用编号

13 个数据库交叉引用编号

ChEBI: CHEBI:62455
KEGG: C19833
PubChem: 122857
PubChem: 609334
Metlin: METLIN73386
ChEMBL: CHEMBL2023103
ChemIDplus: 0000465021
MetaCyc: GERMANICOL
CAS: 465-02-1
medchemexpress: HY-121199
PMhub: MS000027474
PubChem: 135626300
KNApSAcK: C00037176

分类词条

三萜类

代谢反应

9 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(2)

pentacyclic triterpene biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ β-amyrin
mangrove triterpenoid biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ β-amyrin

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(7)

mangrove triterpenoid biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ β-amyrin
mangrove triterpenoid biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ β-amyrin
mangrove triterpenoid biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ lupeol
mangrove triterpenoid biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ β-amyrin
mangrove triterpenoid biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ α-amyrin
pentacyclic triterpene biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ isomultiflorenol
pentacyclic triterpene biosynthesis: (3S)-2,3-epoxy-2,3-dihydrosqualene ⟶ isomultiflorenol

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

76 个相关的物种来源信息

216479 Euphorbia maculata: 10.1016/0031-9422(88)83136-4
526203 Euphorbia supina: 10.1016/0031-9422(88)83136-4
2907091 Cnidoscolus texanus: 10.1055/S-2007-990226
29780 Mangifera indica: 10.1007/BF02541638
2067294 Chrysolaena propinqua: 10.1016/0031-9422(92)90045-R
464037 Festuca argentina: 10.1007/S11745-997-0026-Z
79557 Barringtonia asiatica: 10.1248/CPB.59.778
75948 Lactuca saligna: 10.3109/13880209209054625
3527 Phytolacca americana: 10.1007/BF02534064
4443 Camellia japonica:
292385 Vitellaria paradoxa: 10.1007/BF02534064
4442 Camellia sinensis: 10.1007/BF02534064
385388 Camellia oleifera: 10.1248/CPB.45.2016
182300 Camellia sasanqua: 10.1248/CPB.45.2016
318058 Ixeris chinensis:
4146 Olea europaea: 10.1007/BF02541591
29760 Vitis vinifera: 10.1007/BF00580051
986255 Marsypianthes chamaedrys:
212690 Picris hieracioides: 10.1248/CPB.43.1634
50193 Sonchus asper: 10.5650/JOS1956.29.82
49216 Salvia pratensis: 10.1016/S0031-9422(00)97947-0
268092 Gelasia cretica: 10.1021/NP0103665
216479 Euphorbia maculata: 10.1016/0031-9422(88)80772-6
526203 Euphorbia supina: 10.1016/0031-9422(88)80772-6
35942 Cuphea wrightii: 10.1016/S0305-1978(02)00159-X
3258 Equisetum arvense: 10.1016/0031-9422(73)80050-0
37495 Euphorbia pulcherrima: 10.1021/NP50030A022
2492454 Vernonia incana: 10.1016/0031-9422(90)89059-I
4305 Celastraceae: 10.1016/J.EJMECH.2012.03.035
107821 Barringtonia racemosa: 10.1002/CHIN.200630195
371726 Pistacia lentiscus: 10.1016/0031-9422(91)80095-I
4236 Lactuca sativa: 10.1042/BST0110595
316878 Cnidoscolus urens: 10.1016/S0031-9422(00)94550-3
3991 Euphorbia characias: 10.1515/ZNC-1988-11-1202
38846 Euphorbia peplus: 10.1515/ZNC-1988-11-1202
1087772 Euphorbia nicaeensis: 10.1515/ZNC-1988-11-1202
122539 Koelpinia linearis: 10.1016/S0031-9422(99)00490-2
75947 Lactuca virosa: 10.1039/JR9440000283
216479 Euphorbia maculata: 10.1016/0031-9422(88)83136-4
526203 Euphorbia supina: 10.1016/0031-9422(88)83136-4
2907091 Cnidoscolus texanus: 10.1055/S-2007-990226
29780 Mangifera indica: 10.1007/BF02541638
2067294 Chrysolaena propinqua: 10.1016/0031-9422(92)90045-R
464037 Festuca argentina: 10.1007/S11745-997-0026-Z
79557 Barringtonia asiatica: 10.1248/CPB.59.778
75948 Lactuca saligna: 10.3109/13880209209054625
3527 Phytolacca americana: 10.1007/BF02534064
4443 Camellia japonica:
292385 Vitellaria paradoxa: 10.1007/BF02534064
4442 Camellia sinensis: 10.1007/BF02534064
385388 Camellia oleifera: 10.1248/CPB.45.2016
182300 Camellia sasanqua: 10.1248/CPB.45.2016
318058 Ixeris chinensis:
4146 Olea europaea: 10.1007/BF02541591
29760 Vitis vinifera: 10.1007/BF00580051
986255 Marsypianthes chamaedrys:
212690 Picris hieracioides: 10.1248/CPB.43.1634
50193 Sonchus asper: 10.5650/JOS1956.29.82
49216 Salvia pratensis: 10.1016/S0031-9422(00)97947-0
268092 Gelasia cretica: 10.1021/NP0103665
216479 Euphorbia maculata: 10.1016/0031-9422(88)80772-6
526203 Euphorbia supina: 10.1016/0031-9422(88)80772-6
35942 Cuphea wrightii: 10.1016/S0305-1978(02)00159-X
3258 Equisetum arvense: 10.1016/0031-9422(73)80050-0
37495 Euphorbia pulcherrima: 10.1021/NP50030A022
2492454 Vernonia incana: 10.1016/0031-9422(90)89059-I
4305 Celastraceae: 10.1016/J.EJMECH.2012.03.035
107821 Barringtonia racemosa: 10.1002/CHIN.200630195
371726 Pistacia lentiscus: 10.1016/0031-9422(91)80095-I
4236 Lactuca sativa: 10.1042/BST0110595
316878 Cnidoscolus urens: 10.1016/S0031-9422(00)94550-3
3991 Euphorbia characias: 10.1515/ZNC-1988-11-1202
38846 Euphorbia peplus: 10.1515/ZNC-1988-11-1202
1087772 Euphorbia nicaeensis: 10.1515/ZNC-1988-11-1202
122539 Koelpinia linearis: 10.1016/S0031-9422(99)00490-2
75947 Lactuca virosa: 10.1039/JR9440000283

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

Ping Wang, Stacy Ownby, Zhizhen Zhang, Wei Yuan, Shiyou Li. Cytotoxicity and inhibition of DNA topoisomerase I of polyhydroxylated triterpenoids and triterpenoid glycosides. Bioorganic & medicinal chemistry letters. 2010 May; 20(9):2790-6. doi: 10.1016/j.bmcl.2010.03.063. [PMID: 20371180]
T Akihisa, J Ogihara, J Kato, K Yasukawa, M Ukiya, S Yamanouchi, K Oishi. Inhibitory effects of triterpenoids and sterols on human immunodeficiency virus-1 reverse transcriptase. Lipids. 2001 May; 36(5):507-12. doi: 10.1007/s11745-001-0750-4. [PMID: 11432464]
R P Wilson, P L Fowlkes. Activity of glutamine synthetase in channel catfish tissues determined by an improved tissue assay method. Comparative biochemistry and physiology. B, Comparative biochemistry. 1976; 54(3):365-8. doi: 10.1016/0305-0491(76)90258-3. [PMID: 6197]