Procyanidin B4 (BioDeep_00000402839)

natural product PANOMIX_OTCML-2023 PANOMIX-Anthocyanidin Volatile Flavor Compounds

代谢物信息卡片

(4,8-Bi-2H-1-benzopyran)-3,3,5,5,7,7-hexol, 2,2-bis(3,4-dihydroxyphenyl)-3,34,4-tetrahydro-, (2R-(2alpha,3beta,4alpha(2R*,3R*)))-

化学式: C30H26O12 (578.1424196)
中文名称: 原花青素B4
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O
InChI: InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26+,27+,28-,29-/m1/s1

描述信息

同义名列表

13 个代谢物同义名

(4,8-Bi-2H-1-benzopyran)-3,3,5,5,7,7-hexol, 2,2-bis(3,4-dihydroxyphenyl)-3,34,4-tetrahydro-, (2R-(2alpha,3beta,4alpha(2R*,3R*)))-; (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-chroman-8-yl]chroman-3,5,7-triol; (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychroman-8-yl]chroman-3,5,7-triol; (2R,3S,4S)-2-(3,4-dihydroxyphenyl)-4-[(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-8-chromanyl]chroman-3,5,7-triol; Catechin-(4.alpha.-->8)epicatechin; Catechin-(4alpha->8)-epicatechin; Procyanidin B4; Procyanidol B4; AIDS-082355; 29106-51-2; AIDS082355; C10238; Procyanidin B4

数据库引用编号

9 个数据库交叉引用编号

ChEBI: CHEBI:27589
PubChem: 147299
ChEMBL: CHEMBL447373
CAS: 29106-51-2
MoNA: PM004104
RefMet: Procyanidin B4
KEGG: C10238
PubChem: 12424
KNApSAcK: 27589

分类词条

Proanthocyanidins

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)

53 个相关的物种来源信息

3625 - Actinidia chinensis: 10.1021/JF000549H
4615 - Ananas comosus: 10.1021/JF000549H
301862 - Annona reticulata: 10.1021/JF000549H
184783 - Areca catechu: 10.1155/2013/412851
4442 - Camellia sinensis:
4072 - Capsicum annuum: 10.1021/JF000549H
21019 - Castanea: 10.1021/JF000549H
128292 - Chimarrhis turbinata: 10.1590/S0103-50532005000800008
3827 - Cicer arietinum: 10.1021/JF000549H
119260 - Cinnamomum aromaticum: 10.1016/0031-9422(90)80121-V
1155220 - Cinnamomum iners: 10.1016/0031-9422(90)80121-V
128608 - Cinnamomum verum: 10.1016/0031-9422(90)80121-V
401069 - Coleogyne ramosissima: 10.1016/S0031-9422(00)00192-8
323063 - Croton lechleri: 10.1016/0031-9422(91)85063-6
3663 - Cucurbita pepo: 10.1021/JF000549H
36609 - Cydonia: 10.1021/JF000549H
4039 - Daucus carota: 10.1021/JF000549H
35925 - Diospyros kaki: 10.1021/JF000549H
3494 - Ficus carica: 10.1021/JF000549H
3746 - Fragaria: 10.1021/JF000549H
229543 - Hibiscus cannabinus: 10.1007/BF00574392
224740 - Juniperus sabina: 10.1007/BF00580451
4236 - Lactuca sativa: 10.1021/JF000549H
3864 - Lens culinaris: 10.1021/JF000549H
3750 - Malus domestica:
283210 - Malus pumila:
36616 - Mespilus germanica: 10.1021/JF000549H
4640 - Musa: 10.1021/JF000549H
392747 - Paullinia cupana: 10.3390/12081950
3435 - Persea americana: 10.1021/JF000549H
3885 - Phaseolus vulgaris: 10.1021/JF000549H
3888 - Pisum sativum: 10.1021/JF000549H
36596 - Prunus armeniaca: 10.1021/JF000549H
42229 - Prunus avium: 10.1021/JF000549H
3758 - Prunus domestica: 10.1021/JF000549H
3760 - Prunus persica: 10.1021/JF000549H
3357 - Pseudotsuga menziesii: 10.1016/0031-9422(92)80317-8
22663 - Punica granatum: 10.1021/JF000549H
23211 - Pyrus communis: 10.1021/JF000549H
175228 - Ribes rubrum: 10.1021/JF000549H
117262 - Rosa henryi: 10.1248/CPB.40.1997
23216 - Rubus: 10.1021/JF000549H
41241 - Rumex acetosa: 10.1016/J.FITOTE.2009.08.015
4081 - Solanum lycopersicum: 10.1021/JF000549H
4111 - Solanum melongena: 10.1021/JF000549H
443222 - Toona sinensis: 10.1007/S10600-009-9289-Y
1640457 - Trichilia catigua: 10.1590/S0103-50532011001100010
4565 - Triticum aestivum: 10.1021/JF000549H
3906 - Vicia faba:
29760 - Vitis vinifera:
354529 - Zanthoxylum piperitum: 10.1271/BBB.50669
33090 - 枇杷叶: -
33090 - 金荞麦: -

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。