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Details

Stereochemistry RACEMIC
Molecular Formula C28H40O8
Molecular Weight 504.6124
Optical Activity ( + / - )
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Taxusin, (±)-

SMILES

CC(=O)O[C@H]1CC[C@]2(C)[C@H](C[C@@H]3C[C@H](OC(C)=O)C(C)=C([C@@H](OC(C)=O)[C@@H]2OC(C)=O)C3(C)C)C1=C

InChI

InChIKey=SKJSIVQEPKBFTJ-HUWILPJBSA-N
InChI=1S/C28H40O8/c1-14-21-12-20-13-23(34-17(4)30)15(2)24(27(20,7)8)25(35-18(5)31)26(36-19(6)32)28(21,9)11-10-22(14)33-16(3)29/h20-23,25-26H,1,10-13H2,2-9H3/t20-,21-,22+,23+,25-,26+,28-/m1/s1

HIDE SMILES / InChI

Molecular Formula C28H40O8
Molecular Weight 504.6124
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 16:03:05 GMT 2025
Edited
by admin
on Wed Apr 02 16:03:05 GMT 2025
Record UNII
JP9WH8FUV6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Taxusin, (±)-
Common Name English
(±)-Taxusin
Preferred Name English
6,10-Methanobenzocyclodecene-3,8,11,12-tetrol, 1,2,3,4,4a,5,6,7,8,11,12,12a-dodecahydro-9,12a,13,13-tetramethyl-4-methylene-, tetraacetate, (3?,4a?,6?,8?,11?,12?,12a?)-
Systematic Name English
Code System Code Type Description
FDA UNII
JP9WH8FUV6
Created by admin on Wed Apr 02 16:03:05 GMT 2025 , Edited by admin on Wed Apr 02 16:03:05 GMT 2025
PRIMARY
CAS
184180-91-4
Created by admin on Wed Apr 02 16:03:05 GMT 2025 , Edited by admin on Wed Apr 02 16:03:05 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE