BGC > CAS Search > 79592-91-9

Molecular Formula: C35H49NO10
Molecular Weight: 643.76426

Description :
Crassicauline A is extracted from roots of Aconitum transsectum Diels. It possessed feeding deterrent activity against T. castaneum adults.

• Molecular Weight :643.8
• Purity :> 98%

Molecular Formula :
C35H49NO10
Canonical SMILES :
CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=C(C=C7)OC)O)OC)OC(=O)C)OC)OC)COC
InChI :
InChI=1S/C35H49NO10/c1-8-36-17-32(18-40-3)14-13-23(42-5)35-22-15-33(39)24(43-6)16-34(46-19(2)37,26(29(35)36)27(44-7)28(32)35)25(22)30(33)45-31(38)20-9-11-21(41-4)12-10-20/h9-12,22-30,39H,8,13-18H2,1-7H3
InChIKey :
GAZDXIGXYWVWQX-UHFFFAOYSA-N
Appearance :
Crystalline
Synonyms :
3-Deoxyyunaconitine; Crassicauline I

More details are to be found here

Description :
Crassicauline A is extracted from roots of Aconitum transsectum Diels. It possessed feeding deterrent activity against T. castaneum adults.

• Molecular Weight :643.8
• Purity :> 98%

Molecular Formula :
C35H49NO10
Canonical SMILES :
CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=C(C=C7)OC)O)OC)OC(=O)C)OC)OC)COC
InChI :
InChI=1S/C35H49NO10/c1-8-36-17-32(18-40-3)14-13-23(42-5)35-22-15-33(39)24(43-6)16-34(46-19(2)37,26(29(35)36)27(44-7)28(32)35)25(22)30(33)45-31(38)20-9-11-21(41-4)12-10-20/h9-12,22-30,39H,8,13-18H2,1-7H3
InChIKey :
GAZDXIGXYWVWQX-UHFFFAOYSA-N
Appearance :
Crystalline
Synonyms :
3-Deoxyyunaconitine; Crassicauline I

More details are to be found here