7-Xylosyl-10-deacetyltaxol B

For Research Use Only.
Category
Diterpenoids
Cat.No.
NP1423
CAS
90332-64-2
Product Name
7-Xylosyl-10-deacetyltaxol B
Structure

Product Details

Description
7-Xylosyl-10-deacetyltaxol B is extracted from the barks of Taxus wallichiana Zucc.
Synonyms
Deacety-7-Xylosylcephalomannine, 10-(RG); 10-Deacetyl-7-xylosyltaxol B; 10-Deacetylcephalomannine 7-xyloside; 7-Xylosyl-10-deacetylcephalomannine
IUPAC Name
[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1,12-dihydroxy-15-[(2R,3S)-2-hydroxy-3-[[(E)-2-methylbut-2-enoyl]amino]-3-phenylpropanoyl]oxy-10,14,17,17-tetramethyl-11-oxo-9-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
Molecular Weight
921.97
Molecular Formula
C48H59NO17
Canonical SMILES
CC=C(C)C(=O)NC(C1=CC=CC=C1)C(C(=O)OC2CC3(C(C4C(C(CC5C4(CO5)OC(=O)C)OC6C(C(C(CO6)O)O)O)(C(=O)C(C(=C2C)C3(C)C)O)C)OC(=O)C7=CC=CC=C7)O)O
InChI
InChI=1S/C48H59NO17/c1-8-23(2)41(57)49-33(26-15-11-9-12-16-26)36(54)43(59)63-29-20-48(60)40(65-42(58)27-17-13-10-14-18-27)38-46(7,39(56)35(53)32(24(29)3)45(48,5)6)30(19-31-47(38,22-62-31)66-25(4)50)64-44-37(55)34(52)28(51)21-61-44/h8-18,28-31,33-38,40,44,51-55,60H,19-22H2,1-7H3,(H,49,57)/b23-8+/t28-,29+,30+,31-,33+,34+,35-,36-,37-,38+,40+,44+,46-,47+,48-/m1/s1
InChIKey
YAOWLIDDDUBAEI-ZVZSAYPQSA-N
Boiling Point
1041.3±65.0 °C(Predicted)
Purity
97.0%
Density
1.43±0.1 g/cm3(Predicted)
Appearance
Powder
Color
Yellow
Form
Powder
Packaging
5 mg
pKa
11.26±0.70(Predicted)
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