nahuoic acid A

Ligand id: 7022

Name: nahuoic acid A

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 6
Rotatable bonds 10
Topological polar surface area 138.45
Molecular weight 522.36
XLogP 2.46
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2E)-3-[(1R,2R,4aR,5R,7R,8R,8aS)-5,7-dihydroxy-3,4a,8-trimethyl-2-[(2E,5S,7R,8S,9S)-5,7,9-trihydroxy-8,10-dimethylundec-2-en-2-yl]-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-2-methylprop-2-enoic acid
Database Links
PubChem CID 71521340
Search Google for chemical match using the InChIKey ZNAYXHSDZPSFLO-UWXUHECCSA-N
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Search UniChem for chemical match using the InChIKey ZNAYXHSDZPSFLO-UWXUHECCSA-N
Search UniChem for chemicals with the same backbone ZNAYXHSDZPSFLO
Comments
Isolated from a culture of a Streptomyces sp. obtained from a tropical marine sediment [1].