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Product Overview

Product Code

TRC-O850110

CAS Number

92950-42-0

Product Format

Neat

Molecular Formula

C29H34O10

Molecular Weight

542.57

API Family

Cephalomannine

Product Categories

Impurity Reference Materials , Additional Cancer Bioactive Molecules, TRC, Natural Products

Product Type

Impurity, API, Synthesis tool

Documentation

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Product Information

Chemical Data

Analyte Name

13-Oxo-10-deacetyl Baccatin III

CAS Number

92950-42-0

Molecular Formula

C29H34O10

Molecular Weight

542.57

Accurate Mass

542.2152

SMILES

CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(CC1=O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O

InChI

InChI=1S/C29H34O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,18-19,21-22,24,32-33,36H,11-13H2,1-5H3/t18-,19+,21+,22-,24-,27+,28-,29+/m0/s1

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Cephalomannine

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