Description
Zeorin (6alpha,22-Hopanediol) is a natural triterpenoid found in the roots of Tripterygium regelii, it exhibits the activity of antimycobacterial. 6alpha,22-Hopanediol shows strong activity against bacteria and fungi.
Synonyms
6alpha,22-Hopanediol
IUPAC Name
(3S,3aS,5aR,5bR,7S,7aS,11aR,11bR,13aR,13bS)-3-(2-hydroxypropan-2-yl)-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-7-ol
Molecular Formula
C30H52O2
Canonical SMILES
CC1(CCCC2(C1C(CC3(C2CCC4C3(CCC5C4(CCC5C(C)(C)O)C)C)C)O)C)C
InChI
1S/C30H52O2/c1-25(2)14-9-15-28(6)23-11-10-22-27(5)16-12-19(26(3,4)32)20(27)13-17-29(22,7)30(23,8)18-21(31)24(25)28/h19-24,31-32H,9-18H2,1-8H3/t19-,20-,21-,22+,23+,24-,27-,28+,29+,30+/m0/s1
InChIKey
KYBLAIAGFNCVHL-PMVHANJISA-N
Boiling Point
515.6±23.0 °C(Predicted)
Application
antimycobacterial
Definition
ChEBI: A hopanoid that is hopane substituted by hydroxy groups at positions 6 and 22 (the (6alpha)-stereoisomer). It has been isolated from the fungi Aschersonia and Hypocrella.
pKa
14.98±0.70(Predicted)