more general categories
information about this item
03. Biological Effects of Specific Chemicals
03. Biological Effects of Specific Chemicals
amarogentin [CHEBI:2622] (1)
amarogentin [CHEBI:2622] (1)
06. Name of Biological Source of Chemical
06. Name of Biological Source of Chemical
Swertia chirata (7)
Swertia japonica (7)
Swertia mileensis (7)
07. Part of Biological Source of Chemical
07. Part of Biological Source of Chemical
unspecified structure [PO:0000004] (703)
08. Chemical Category
08. Chemical Category
amarogentin [CHEBI:2622] (1)
amarogentin [CHEBI:2622] (1)
amarogentin [CHEBI:2622] (1)
amarogentin [CHEBI:2622] (1)
amarogentin [CHEBI:2622] (1)
amarogentin [CHEBI:2622] (1)
ChEBI Compound Accession Identifier :
[CHEBI:2622]
ChEBI Compound Description :
A secoiridoid glycoside that consists of (4aS,5R,6R)-5-ethenyl-6-hydroxy-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one having a 2-O-[(3,3',5-trihydroxybiphenyl-2-yl)carbonyl]-beta-D-glucopyranosyl group attached at position 6 via a glycosidic linkage.
ChEBI Compound Identification Number :
2622
ChEBI InChI Value :
InChI=1S/C29H30O13/c1-2-16-17-6-7-38-26(36)19(17)12-39-28(16)42-29-25(24(35)23(34)21(11-30)40-29)41-27(37)22-18(9-15(32)10-20(22)33)13-4-3-5-14(31)8-13/h2-5,8-10,12,16-17,21,23-25,28-35H,1,6-7,11H2/t16-,17+,21-,23-,24+,25-,28+,29+/m1/s1
ChEBI InChIKey Value :
DBOVHQOUSDWAPQ-WTONXPSSSA-N
ChEBI Compound Name :
amarogentin
ChEBI SMILES Value :
[H][C@@]12CCOC(=O)C1=CO[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)c1c(O)cc(O)cc1-c1cccc(O)c1)[C@@H]2C=C
ChEBI Substance ID :
8146424
ChEBI URL :
ChEBI:2622
ChemSpider ID :
NS
Ontomatica Chemical Accession Key (OnChAKey) :
DBOVHQOUSDWAPQ_WTONXPSSSA_N_000_000000
PubChem Compound ID :
115149