Scutebata F

For Research Use Only.
Category
Diterpenoids
Cat.No.
NP1706
CAS
1207181-62-1
Product Name
Scutebata F
Structure

Product Details

Description
Scutebata F is from the herbs of Scutellaria barbata D.Don
Synonyms
Barbatine C
IUPAC Name
[(3S,4aR,5S,6R,6aR,10R,10aS,10bR)-5,6-diacetyloxy-4a,6a,7,10b-tetramethyl-2'-oxospiro[2,5,6,9,10,10a-hexahydro-1H-benzo[f]chromene-3,4'-oxolane]-10-yl] pyridine-3-carboxylate
Molecular Weight
555.6
Molecular Formula
C30H37NO9
Canonical SMILES
CC1=CCC(C2C1(C(C(C3(C2(CCC4(O3)CC(=O)OC4)C)C)OC(=O)C)OC(=O)C)C)OC(=O)C5=CN=CC=C5
InChI
InChI=1S/C30H37NO9/c1-17-9-10-21(39-26(35)20-8-7-13-31-15-20)23-27(4)11-12-30(14-22(34)36-16-30)40-29(27,6)25(38-19(3)33)24(28(17,23)5)37-18(2)32/h7-9,13,15,21,23-25H,10-12,14,16H2,1-6H3/t21-,23-,24+,25+,27-,28+,29+,30+/m1/s1
InChIKey
NVJGRPGPCIYGRC-LZUUMNQWSA-N
Purity
>95%
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1 mg
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