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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O2
Molecular Weight 234.334
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZIZANOIC ACID

SMILES

[H][C@]12CC[C@H](C(O)=O)[C@@]13CC[C@H](C3)C(C)(C)C2=C

InChI

InChIKey=IJGMVUXEZUEDJR-RTWAVKEYSA-N
InChI=1S/C15H22O2/c1-9-11-4-5-12(13(16)17)15(11)7-6-10(8-15)14(9,2)3/h10-12H,1,4-8H2,2-3H3,(H,16,17)/t10-,11-,12-,15-/m1/s1

HIDE SMILES / InChI

Description

Zizanoic acid is a sesquiterpene in vetiver oil. Zizanoic acid exhibited significant antimycobacterial activity against drug-resistant mutants of M. smegmatis and virulent strain H37Rv of M. tuberculosis. These observations may be of great help in the QSAR-based antimycobacterial drug designing from a very common, inexpensive and non-toxic natural product for the management of MDR and XDR tuberculosis.

Originator

Approval Year

Targets

Primary TargetPharmacologyConditionPotency

Conditions

ConditionModalityTargetsHighest PhaseProduct
Curative
Unknown
Curative
Unknown

PubMed

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Zizanoic acid inhibited Mycobacterium smegmatis with MIC 12.5 ug/ml