(3ß,5ß,16ß)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
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Product Description
Product
(3ß,5ß,16ß)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
CAS
595-21-1
Formula
C30H46O9
Synonym
(3beta,5beta,16beta)-3-((6-Deoxy-3-O-methyl-D-galactopyranosyl)oxy)-14,16-dihydroxycard-20(22)-enolide; (3beta,5beta,16beta)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide; 3-[(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-3,5-dihydroxy-4-methoxy-6-methyl-oxan-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one; 3-[(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one; 3ß-[(6-Deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16ß-dihydroxy-5ß-card-20(22)-enolide; 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-D-galactopyranosyl)oxy)-14,16-dihydroxy-; Desgluco-digitalinum verum; Desgluco-digitalinum verum [German]; Digicoside; EINECS 209-859-8; Gitoxigenin 3-O-monodigitaloside; Gitoxogenin-D-digitalosid; Gitoxogenin-D-digitalosid [German]; Stropesid; Strospesid; Strospesid [German]; Strospeside
Typical Product Specifications
EINECS
209-859-8
SMILES
C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)O)O)C)C)O)OC)O
InChI
CPFNIKYEDJFRAT-RVPZLBNISA-N
InChIKey
1S/C30H46O9/c1-15-24(33)26(36-4)25(34)27(38-15)39-18-7-9-28(2)17(12-18)5-6-20-19(28)8-10-29(3)23(16-11-22(32)37-14-16)21(31)13-30(20,29)35/h11,15,17-21,23-27,31,33-35H,5-10,12-14H2,1-4H3/t15-,17-,18+,19+,20-,21+,23+,24+,25-,26+,27+,28+,29-,30+/m1/s1
log P (octanol-water)
0.59
Water solubility
106 mg/L
Vapor Pressure
9.84E-21 mm Hg
Henry's Law Constant
9.81E-19 atm-m3/mole
Atmospheric OH Rate Constant
1.32E-10 cm3/molecule-sec
Class
(3ß,5ß,16ß)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
Product Description
Product
(3ß,5ß,16ß)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
CAS
595-21-1
Formula
C30H46O9
Synonym
(3beta,5beta,16beta)-3-((6-Deoxy-3-O-methyl-D-galactopyranosyl)oxy)-14,16-dihydroxycard-20(22)-enolide; (3beta,5beta,16beta)-3-[(6-deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide; 3-[(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-3,5-dihydroxy-4-methoxy-6-methyl-oxan-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one; 3-[(3S,5R,10S,13R,14S,17R)-3-[(2R,5S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14,16-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one; 3ß-[(6-Deoxy-3-O-methyl-D-galactopyranosyl)oxy]-14,16ß-dihydroxy-5ß-card-20(22)-enolide; 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-D-galactopyranosyl)oxy)-14,16-dihydroxy-; Desgluco-digitalinum verum; Desgluco-digitalinum verum [German]; Digicoside; EINECS 209-859-8; Gitoxigenin 3-O-monodigitaloside; Gitoxogenin-D-digitalosid; Gitoxogenin-D-digitalosid [German]; Stropesid; Strospesid; Strospesid [German]; Strospeside
Typical Product Specifications
EINECS
209-859-8
SMILES
C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)O)O)C)C)O)OC)O
InChI
CPFNIKYEDJFRAT-RVPZLBNISA-N
InChIKey
1S/C30H46O9/c1-15-24(33)26(36-4)25(34)27(38-15)39-18-7-9-28(2)17(12-18)5-6-20-19(28)8-10-29(3)23(16-11-22(32)37-14-16)21(31)13-30(20,29)35/h11,15,17-21,23-27,31,33-35H,5-10,12-14H2,1-4H3/t15-,17-,18+,19+,20-,21+,23+,24+,25-,26+,27+,28+,29-,30+/m1/s1
log P (octanol-water)
0.59
Water solubility
106 mg/L
Vapor Pressure
9.84E-21 mm Hg
Henry's Law Constant
9.81E-19 atm-m3/mole
Atmospheric OH Rate Constant
1.32E-10 cm3/molecule-sec
Class
