Veratridine
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Product Description
Product
Veratridine
CAS
71-62-5
Formula
C36H51NO11
Synonym
VERATRIDINE; Veratrine; Veratrine (amorphous); Veratrine (amorphous) (VAN); veratrine(amorphous); ybenzoate); ,4alpha,16beta)-; 3-VERATROYLVERACEVINE; 4,9-Epoxycevane-3,4,12,14,16,17,20-heptol 3-(3,4-dimethoxybenzoate); 4,9-epoxycevane-3,4,12,14,16,17,20-heptol3-(3,4-dimethoxybenzoate); 4,9-Epoxycevane-3beta,4alpha,12,14,16beta,17,20-heptol 3-veratrate; 5-21-13-00709 (Beilstein Handbook Reference); BRN 0078875; Cevane-3,4,12,14,16,17,20-heptol, 4,9-epoxy-, 3-(3,4-dimethoxybenzoate), (3beta,4alpha,16beta)-; cevane-3,4,12,14,16,17,20-heptol,4,9-epoxy-,3-(3,4-dimethoxybenzoate),(3beta; Cevane-3-beta,4-alpha,12,14,16-beta,17,20-heptol, 4,9-epoxy-, 3-(3,4-dimethoxybenzoate); cevane-3-beta,4-alpha,12,14,16-beta,17,20-heptol,4,9-epoxy-,3-(3,4-dimethox; EINECS 200-758-4; HSDB 4078; NSC 7524; UNII-M4BNP1KR7W
Typical Product Specifications
Molecular weight
673.79
EINECS
200-758-4
SMILES
C1[C@@]23[C@H]([C@@]4(C[C@H](O)[C@@]5([C@H]([C@@]14O)C[N@@]1C[C@@H](C)CC[C@@H]1[C@@]5(C)O)O)O)CC[C@H]1[C@@]2(CC[C@@H]([C@@]1(O3)O)OC(c1cc(c(OC)cc1)OC)=O)C
InChI
FVECELJHCSPHKY-YFUMOZOISA-N
InChIKey
1S/C36H51NO11/c1-19-6-11-26-31(3,40)35(43)25(17-37(26)16-19)33(42)18-34-24(32(33,41)15-27(35)38)10-9-23-30(34,2)13-12-28(36(23,44)48-34)47-29(39)20-7-8-21(45-4)22(14-20)46-5/h7-8,14,19,23-28,38,40-44H,6,9-13,15-18H2,1-5H3/t19-,23-,24-,25-,26-,27-,28-,
log P (octanol-water)
3.760
Atmospheric OH Rate Constant
1.60E-10 cm3/molecule-sec
pKa Dissociation Constant
9.54
Melting Point
180 ° C
Class
Veratridine
Product Description
Product
Veratridine
CAS
71-62-5
Formula
C36H51NO11
Synonym
VERATRIDINE; Veratrine; Veratrine (amorphous); Veratrine (amorphous) (VAN); veratrine(amorphous); ybenzoate); ,4alpha,16beta)-; 3-VERATROYLVERACEVINE; 4,9-Epoxycevane-3,4,12,14,16,17,20-heptol 3-(3,4-dimethoxybenzoate); 4,9-epoxycevane-3,4,12,14,16,17,20-heptol3-(3,4-dimethoxybenzoate); 4,9-Epoxycevane-3beta,4alpha,12,14,16beta,17,20-heptol 3-veratrate; 5-21-13-00709 (Beilstein Handbook Reference); BRN 0078875; Cevane-3,4,12,14,16,17,20-heptol, 4,9-epoxy-, 3-(3,4-dimethoxybenzoate), (3beta,4alpha,16beta)-; cevane-3,4,12,14,16,17,20-heptol,4,9-epoxy-,3-(3,4-dimethoxybenzoate),(3beta; Cevane-3-beta,4-alpha,12,14,16-beta,17,20-heptol, 4,9-epoxy-, 3-(3,4-dimethoxybenzoate); cevane-3-beta,4-alpha,12,14,16-beta,17,20-heptol,4,9-epoxy-,3-(3,4-dimethox; EINECS 200-758-4; HSDB 4078; NSC 7524; UNII-M4BNP1KR7W
Typical Product Specifications
Molecular weight
673.79
EINECS
200-758-4
SMILES
C1[C@@]23[C@H]([C@@]4(C[C@H](O)[C@@]5([C@H]([C@@]14O)C[N@@]1C[C@@H](C)CC[C@@H]1[C@@]5(C)O)O)O)CC[C@H]1[C@@]2(CC[C@@H]([C@@]1(O3)O)OC(c1cc(c(OC)cc1)OC)=O)C
InChI
FVECELJHCSPHKY-YFUMOZOISA-N
InChIKey
1S/C36H51NO11/c1-19-6-11-26-31(3,40)35(43)25(17-37(26)16-19)33(42)18-34-24(32(33,41)15-27(35)38)10-9-23-30(34,2)13-12-28(36(23,44)48-34)47-29(39)20-7-8-21(45-4)22(14-20)46-5/h7-8,14,19,23-28,38,40-44H,6,9-13,15-18H2,1-5H3/t19-,23-,24-,25-,26-,27-,28-,
log P (octanol-water)
3.760
Atmospheric OH Rate Constant
1.60E-10 cm3/molecule-sec
pKa Dissociation Constant
9.54
Melting Point
180 ° C
Class
