Protogracillin (BioDeep_00001867500)

PANOMIX_OTCML-2023 Volatile Flavor Compounds

代谢物信息卡片

(3beta,22alpha,25R)-26-(beta-D-Glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-->2)-O-[beta-D-glucopyranosyl-(1-->3)]-beta-D-glucopyranoside

化学式: C51H84O23 (1064.5403114)
中文名称: 原纤细薯蓣皂苷, 原纤细薯蓣皂甙
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC1C2C(CC3C2(CCC4C3CC=C5C4(CCC(C5)OC6C(C(C(C(O6)CO)O)OC7C(C(C(C(O7)CO)O)O)O)OC8C(C(C(C(O8)C)O)O)O)C)C)OC1(CCC(C)COC9C(C(C(C(O9)CO)O)O)O)O
InChI: InChI=1S/C51H84O23/c1-20(19-66-45-40(62)38(60)34(56)29(16-52)69-45)8-13-51(65)21(2)32-28(74-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)68-48-44(73-46-41(63)37(59)33(55)22(3)67-46)43(36(58)31(18-54)71-48)72-47-42(64)39(61)35(57)30(17-53)70-47/h6,20-22,24-48,52-65H,7-19H2,1-5H3/t20-,21+,22+,24+,25-,26+,27+,28+,29-,30-,31-,32+,33+,34-,35-,36-,37-,38+,39+,40-,41-,42-,43+,44-,45-,46+,47+,48-,49+,50+,51-/m1/s1

描述信息

Protogracillin is a steroid saponin.
Protogracillin is a natural product found in Tribulus terrestris, Paris polyphylla var. chinensis, and other organisms with data available.
Protogracillin is a steroidal saponin isolated from Dioscorea zingiberensis Wright (DZW). Steroidal saponins from DZW rhizomes have the potential to reduce the risk of cardiovascular diseases by anti-thrombotic action[1].
Protogracillin is a steroidal saponin isolated from Dioscorea zingiberensis Wright (DZW). Steroidal saponins from DZW rhizomes have the potential to reduce the risk of cardiovascular diseases by anti-thrombotic action[1].

同义名列表

6 个代谢物同义名

(3beta,22alpha,25R)-26-(beta-D-Glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-->2)-O-[beta-D-glucopyranosyl-(1-->3)]-beta-D-glucopyranoside; (3beta,22R,25R)-26-(beta-D-glucopyranosyloxy)-22-hydroxyfurost-5-en-3-yl 6-deoxy-alpha-L-mannopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->3)]-beta-D-glucopyranoside; PROTOGRACILLIN(P); Proto-Gracillin; Protogracillin; Protogracillin

数据库引用编号

13 个数据库交叉引用编号

ChEBI: CHEBI:8590
KEGG: C08908
PubChem: 441892
ChEMBL: CHEMBL2071193
chemspider: 390468
CAS: 54848-30-5
medchemexpress: HY-N4271
MetaboLights: MTBLC8590
PubChem: 11100
KNApSAcK: C00003586
3DMET: B02514
NIKKAJI: J687.535A
KNApSAcK: 8590

分类词条

类固醇

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)

15 个相关的物种来源信息

35875 - Allium fistulosum: 10.1021/NP900815P
357959 - Dioscorea collettii:
357960 - Dioscorea collettii var. hypoglauca: 10.1055/S-2006-957636
374971 - Dioscorea futschauensis: 10.1007/S11418-006-0126-3
64700 - Dioscorea nipponica: 10.1002/PCA.2428
64701 - Dioscorea septemloba: 10.1248/CPB.22.2164
1933808 - Dioscorea sinuata: 10.1248/CPB.22.2164
394307 - Dioscorea spongiosa:
325984 - Dioscorea zingiberensis: 10.1016/S0928-3420(99)80031-7
49666 - Paris polyphylla: 10.1016/S0960-894X(03)00052-0
221254 - Paris polyphylla var. chinensis: 10.1016/J.JPBA.2011.12.027
33090 - Plants: -
210369 - Tribulus terrestris: 10.1007/BF00601288
78534 - Trigonella foenum-graecum L.: -
33090 - 穿山龙: -

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。

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