Stachybotrolide

For Research Use Only.
Category
Sesquiterpene
Cat.No.
NP5646
CAS
149691-31-6
Product Name
Stachybotrolide
Structure

Product Details

Description
Stachybotrolide is produced by Stachybotrys alternans.
Synonyms
Stachybotrylactone; (2R,2'R,4a'S,6'R,8a'S)-4,6'-dihydroxy-2',5',5',8a'-tetramethyl-3',4',4a',5',6',7',8',8a'-octahydro-2'H,3H-spiro[benzo[2,1-b:3,4-c']difuran-2,1'-naphthalen]-6(8H)-one; Spiro[benzo[2,1-b:3,4-c']difuran-2(3H),1'(2'H)-naphthalen]-6(8H)-one, 3',4',4'a,5',6',7',8',8'a-octahydro-4,6'-dihydroxy-2',5',5',8'a-tetramethyl-, [1'R-(1'α,2'α,4'aα,6'α,8'aβ)]-; Spiro[benzo[2,1-b:3,4-c']difuran-2(3H),1'(2'H)-naphthalen]-6(8H)-one, 3',4',4'a,5',6',7',8',8'a-octahydro-4,6'-dihydroxy-2',5',5',8'a-tetramethyl-, (1'R,2'R,4'aS,6'R,8'aS)-
IUPAC Name
(3R,4aS,7R,8R,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethylspiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[3,4-g][1]benzofuran]-6'-one
Molecular Weight
386.48
Molecular Formula
C23H30O5
Canonical SMILES
CC1CCC2C(C(CCC2(C13CC4=C(C=C5C(=C4O3)COC5=O)O)C)O)(C)C
InChI
InChI=1S/C23H30O5/c1-12-5-6-17-21(2,3)18(25)7-8-22(17,4)23(12)10-14-16(24)9-13-15(19(14)28-23)11-27-20(13)26/h9,12,17-18,24-25H,5-8,10-11H2,1-4H3/t12-,17+,18-,22+,23-/m1/s1
InChIKey
HKNSYAPUOMHZDE-RCJATNNHSA-N
Boiling Point
593.3±50.0°C at 760 mmHg
Purity
97.5%
Density
1.3±0.1 g/cm3
Solubility
Soluble in Methanol
Appearance
Powder
Storage
Store at 2-8°C protect from light
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