Compound Summary
Compound Information
Oolonghomobisflavan B
Compound Name: | Oolonghomobisflavan B |
Compound CID: | 14520995 |
Synonyms: | Oolonghomobisflavan B 6-{5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3-(3,4,5-trihydroxyphenyl)carbonyloxy-3,4-dihydro-2H-1-benzopyran-8-ylmethyl}-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate More... |
Iupac Name: | [8-[[5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)oxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-6-yl]methyl]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate |
InChI: | InChI=1S/C45H36O22/c46-22-12-23(47)20-10-34(65-44(62)16-5-29(53)39(60)30(54)6-16)42(15-3-27(51)38(59)28(52)4-15)67-43(20)19(22)9-18-24(48)13-33-21(36(18)57)11-35(41(64-33)14-1-25(49)37(58)26(50)2-14)66-45(63)17-7-31(55)40(61)32(56)8-17/h1-8,12-13,34-35,41-42,46-61H,9-11H2 |
InChIKey: | FKRUMFFNBGSGGM-UHFFFAOYSA-N |
Canonical Smiles: | C1C(C(OC2=C1C(=CC(=C2CC3=C(C4=C(C=C3O)OC(C(C4)OC(=O)C5=CC(=C(C(=C5)O)O)O)C6=CC(=C(C(=C6)O)O)O)O)O)O)C7=CC(=C(C(=C7)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O |
Isomeric Smiles: | C1C(C(OC2=C1C(=CC(=C2CC3=C(C4=C(C=C3O)OC(C(C4)OC(=O)C5=CC(=C(C(=C5)O)O)O)C6=CC(=C(C(=C6)O)O)O)O)O)O)C7=CC(=C(C(=C7)O)O)O)OC(=O)C8=CC(=C(C(=C8)O)O)O |
Molecular Weight: | 928.8 |
Molecular Formula: | C45H36O22 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Oolonghomobisflavan B
Molecular Weight: | 928.8 |
Molecular Formula: | C45H36O22 |
Hydrogen Bond Donor Count: | 16 |
Hydrogen Bond Acceptor Count: | 22 |
Rotatable Bond Count: | 10 |
Heavy Atom Count: | 67 |
Complexity: | 1650 |
Synonyms
Oolonghomobisflavan B
| Oolonghomobisflavan B | Oolonghomobisflavan B |
|---|---|
Oolonghomobisflavan B |
6-{5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3-(3,4,5-trihydroxyphenyl)carbonyloxy-3,4-dihydro-2H-1-benzopyran-8-ylmethyl}-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate |
Experimental Data
Oolonghomobisflavan B
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 10 | umol/L | 14.92 | 20.01 | 0.34 | S | N2 | 36158534 | Active | ||||
| Caenorhabditis elegans | 5 | umol/L | 14.92 | 19.98 | 0.34 | S | N2 | 36158534 | Active | ||||
| Caenorhabditis elegans | 25 | umol/L | 14.92 | 18.5 | 0.24 | S | N2 | 36158534 | Active | ||||
| Caenorhabditis elegans | 5 | umol/L | 15.56 | 18.52 | 19.02 | 24 | 34 | 0.42 | S | N2 | 34637108 | Active | |
| Caenorhabditis elegans | 25 | umol/L | 15.56 | 17.1 | 9.9 | 24 | 34 | 0.42 | S | N2 | 34637108 | Active | |
| Caenorhabditis elegans | 10 | umol/L | 15.56 | 17.08 | 9.77 | 24 | 32 | 0.33 | S | N2 | 34637108 | Active |
Experimental Data Visualization
Oolonghomobisflavan B
Statistics Data
Oolonghomobisflavan B
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 19.02 | 0.42 | 2 | 6 |
Statistics Data Visualization
Oolonghomobisflavan B
