Compound Summary
carnosol
Compound Information
carnosol
Compound Name: | carnosol |
Compound CID: | 442009 |
Synonyms: | carnosol 5957-80-2 Picrosalvin UNII-483O455CKD CHEBI:3429 More... |
Iupac Name: | (1R,8S,10S)-3,4-dihydroxy-11,11-dimethyl-5-propan-2-yl-16-oxatetracyclo[6.6.2.01,10.02,7]hexadeca-2,4,6-trien-15-one |
InChI: | InChI=1S/C20H26O4/c1-10(2)11-8-12-13-9-14-19(3,4)6-5-7-20(14,18(23)24-13)15(12)17(22)16(11)21/h8,10,13-14,21-22H,5-7,9H2,1-4H3/t13-,14-,20+/m0/s1 |
InChIKey: | XUSYGBPHQBWGAD-PJSUUKDQSA-N |
Canonical Smiles: | CC(C)C1=C(C(=C2C(=C1)C3CC4C2(CCCC4(C)C)C(=O)O3)O)O |
Isomeric Smiles: | CC(C)C1=C(C(=C2C(=C1)[C@@H]3C[C@@H]4[C@@]2(CCCC4(C)C)C(=O)O3)O)O |
Molecular Weight: | 330.4 |
Molecular Formula: | C20H26O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
carnosol
Molecular Weight: | 330.4 |
Molecular Formula: | C20H26O4 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 24 |
Complexity: | 542 |
Synonyms
carnosol
| carnosol | carnosol |
|---|---|
carnosol |
5957-80-2 |
Picrosalvin |
UNII-483O455CKD |
CHEBI:3429 |
CHEMBL218693 |
483O455CKD |
MFCD02752467 |
(4aR,9S,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-2,3,4,9,10,10a-hexahydro-1H-9,4a-(epoxymethano)phenanthren-12-one |
CCRIS 7122 |
HSDB 7680 |
SCHEMBL42365 |
Carnosol, analytical standard |
DTXSID80904451 |
(1R,8S,10S)-3,4-dihydroxy-11,11-dimethyl-5-propan-2-yl-16-oxatetracyclo6.6.2.01,10.02,7hexadeca-2,4,6-trien-15-one |
1,3,4,9,10,10aS-Hexahydro-5,6-dihydroxy-1,1-dimethyl-7-isopropyl-2H-9S,4aR-(epoxymethano)phenanthren-12-one |
HY-N0643 |
ZINC3871891 |
BDBM50213683 |
NSC 39143 |
s9127 |
AKOS015897159 |
CCG-208130 |
2H-9,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR-(4aalpha,9alpha,10abeta))- |
AC-34727 |
CS-0009670 |
N2566 |
V0335 |
C09069 |
957C802 |
BRD-K67265981-001-01-5 |
Q16634054 |
(1R,8S,10S)-3,4-dihydroxy-11,11-dimethyl-5-(propan-2-yl)-16-oxatetracyclo6.6.2.0^{1,10}.0^{2,7}hexadeca-2,4,6-trien-15-one |
Experimental Data
carnosol
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 240.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 120.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 60.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 300.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 180.000000000000000 | umol/L | 19.000000000000000 | S | N2 | 33683565 | Active |
Experimental Data Visualization
carnosol
Statistics Data
carnosol
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 19.000000000000000 | 1 | 5 |
Statistics Data Visualization
carnosol
