14-Deoxy-11-oxoandrographolide

Catalog Number
ANC04927
Product Name
14-Deoxy-11-oxoandrographolide
CAS Number
42895-57-8
IUPAC Name
4-[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]-2-oxoethyl]-2H-furan-5-one
Molecular Formula
C20H28O5
Molecular Weight
348.4
Appearance
Powder
Purity
98%
SMILES
C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)[C@H]2C(=O)CC3=CCOC3=O)(C)CO)O
InChI
InChI=1S/C20H28O5/c1-12-4-5-15-19(2,8-6-16(23)20(15,3)11-21)17(12)14(22)10-13-7-9-25-18(13)24/h7,15-17,21,23H,1,4-6,8-11H2,2-3H3/t15-,16+,17-,19+,20-/m0/s1
InChI Key
WZHWNAKOQGIEEB-NDLGOLERSA-N
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