Compound Summary
Compound Information
Karaviloside III
Compound Name: | Karaviloside III |
Compound CID: | 16093691 |
Synonyms: | Karaviloside III CHEMBL2335924 More... |
Iupac Name: | (2R,3S,4R,5R,6R)-2-(hydroxymethyl)-6-[[(3S,7S,8R,9S,10S,13R,14S,17R)-17-[(E,2R)-6-hydroxy-6-methylhept-4-en-2-yl]-7-methoxy-4,4,9,13,14-pentamethyl-2,3,7,8,10,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol |
InChI: | InChI=1S/C37H62O8/c1-21(11-10-15-33(2,3)42)22-14-16-37(8)31-25(43-9)19-24-23(35(31,6)17-18-36(22,37)7)12-13-27(34(24,4)5)45-32-30(41)29(40)28(39)26(20-38)44-32/h10,15,19,21-23,25-32,38-42H,11-14,16-18,20H2,1-9H3/b15-10+/t21-,22-,23-,25+,26-,27+,28-,29-,30-,31-,32+,35+,36-,37+/m1/s1 |
InChIKey: | SQGCPGUUCGINMK-RWVJRPFNSA-N |
Canonical Smiles: | CC(CC=CC(C)(C)O)C1CCC2(C1(CCC3(C2C(C=C4C3CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)O)OC)C)C)C |
Isomeric Smiles: | C[C@H](C/C=C/C(C)(C)O)[C@H]1CC[C@@]2([C@@]1(CC[C@@]3([C@H]2[C@H](C=C4[C@H]3CC[C@@H](C4(C)C)O[C@H]5[C@@H]([C@@H]([C@@H]([C@H](O5)CO)O)O)O)OC)C)C)C |
Molecular Weight: | 634.9 |
Molecular Formula: | C37H62O8 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Karaviloside III
Molecular Weight: | 634.9 |
Molecular Formula: | C37H62O8 |
Hydrogen Bond Donor Count: | 5 |
Hydrogen Bond Acceptor Count: | 8 |
Rotatable Bond Count: | 8 |
Heavy Atom Count: | 45 |
Complexity: | 1130 |
Synonyms
Karaviloside III
| Karaviloside III | Karaviloside III |
|---|---|
Karaviloside III |
CHEMBL2335924 |
Experimental Data
Karaviloside III
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Saccharomyces cerevisiae | 1 | umol/L | 7.7 | 10.4 | 0.35 | S | K6001 | 29765490 | Active | ||||
| Saccharomyces cerevisiae | 3 | umol/L | 7.7 | 10.7 | 0.39 | S | K6001 | 29765490 | Active |
Experimental Data Visualization
Karaviloside III
Statistics Data
Karaviloside III
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Saccharomyces cerevisiae | 0.39 | 1 | 2 |
Statistics Data Visualization
Karaviloside III
