Simotaxel

Name: Simotaxel
Brand: 2A Biotech
SKU: 2A-9058202

CAS Number791635-59-1

SynonymsMst 997

Molecular FormulaC46H57NO15S

Molecular Weight896.00700

Purity98.00%

Cat. No.: 2A-9058202 Purity: 98.00%

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Quality Control of [ 791635-59-1 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number	791635-59-1
Catalog No.	2A-9058202
Chinese Name	司莫紫杉醇
Synonyms	Mst 997
Molecular Formula	C46H57NO15S
Molecular Weight	896.00700
Purity	98.00
SMILES	CC(=O)OC12COC1CC(O)C1(C)C(=O)C(OC(=O)C3CCCC3)C3=C(C)C(OC(=O)C(O)C(NC(=O)OC(C)C)c4cccs4)CC(O)(C(OC(=O)c4ccccc4)C21)C3(C)C
InChI	InChI=1S/C46H57NO15S/c1-23(2)58-42(55)47-33(29-18-13-19-63-29)34(50)41(54)59-28-21-46(56)38(61-40(53)27-14-9-8-10-15-27)36-44(7,30(49)20-31-45(36,22-57-31)62-25(4)48)37(51)35(32(24(28)3)43(46,5)6)60-39(52)26-16-11-12-17-26/h8-10,13-15,18-19,23,26,28,30-31,33-36,38,49-50,56H,11-12,16-17,20-22H2,1-7H3,(H,47,55)/t28-,30-,31+,33-,34+,35+,36?,38-,44+,45-,46+/m0/s1
InChI Key	SLGIWUWTSWJBQE-VLCCYYTCSA-N

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