Bisandrographolide A

For Research Use Only.
Category
Terpenes
Cat.No.
NP1631
CAS
160498-00-0
Product Name
Bisandrographolide A
Structure

Product Details

Description
Bisandrographolide A is a natural diterpenoid found in the herbs of Andrographis paniculata (Burm. f.) Nees. The compound can activate TRPV4 channels and play a role in some of the effects of Andrographis extract described in traditional medicine.
Synonyms
bisandrographolide
IUPAC Name
4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2-[2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-1-(5-oxo-2H-furan-4-yl)ethyl]-2H-furan-5-one
Molecular Weight
664.88
Molecular Formula
C40H56O8
Canonical SMILES
CC12CCC(C(C1CCC(=C)C2CC(C3C=C(C(=O)O3)C=CC4C(=C)CCC5C4(CCC(C5(C)CO)O)C)C6=CCOC6=O)(C)CO)O
InChI
InChI=1S/C40H56O8/c1-23-7-11-31-37(3,16-13-33(43)39(31,5)21-41)28(23)10-9-25-19-30(48-35(25)45)27(26-15-18-47-36(26)46)20-29-24(2)8-12-32-38(29,4)17-14-34(44)40(32,6)22-42/h9-10,15,19,27-34,41-44H,1-2,7-8,11-14,16-18,20-22H2,3-6H3/b10-9+/t27?,28-,29-,30?,31+,32+,33-,34-,37+,38+,39+,40+/m1/s1
InChIKey
WQHWOZANSOUSAY-LZBAHHAZSA-N
Boiling Point
832.6±65.0 °C(Predicted)
Purity
>96%
Density
1.23±0.1 g/cm3(Predicted)
Appearance
Powder
Form
Powder
Packaging
1 mg
pKa
14.82±0.70(Predicted)
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