Baccatin III

Product Name Baccatin III
Alternate Names Baccatin API Standards, API Standards of Baccatin
CAT No. CS-O-00480
CAS No. 27548-93-2
Category API Standards
Stock IN-Stock
Mol. Wt. 586.63 g/mol
Mol. For. C₃₁H₃₈O₁₁
Hazardous This is a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Baccatin
Purity Not less than 95%
Therapeutic Anti-Cancer / Oncology
Smileys CC(O[C@@]1([C@](C[C@@H]2O)([H])OC1)[C@@]([C@@]2(C3=O)C)([H])[C@@H]([C@@](C4(C)C)(C[C@H](O)C(C)=C4[C@H]3OC(C)=O)O)OC(C5=CC=CC=C5)=O)=O
Canonical Smiles CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)OC(=O)C
InchIKey OVMSOCFBDVBLFW-VHLOTGQHSA-N
Inchl InChI=1S/C31H38O11/c1-15-19(34)13-31(38)26(41-27(37)18-10-8-7-9-11-18)24-29(6,20(35)12-21-30(24,14-39-21)42-17(3)33)25(36)23(40-16(2)32)22(15)28(31,4)5/h7-11,19-21,23-24,26,34-35,38H,12-14H2,1-6H3/t19-,20-,21+,23+,24-,26-,29+,30-,31+/m0/s1
IUPAC [(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-1,9,15-trihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate
Controlled No
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