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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O3
Molecular Weight 250.3334
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 12,13-DEOXYVERRUCAROL

SMILES

[H][C@]12O[C@@H]3C[C@@H](O)[C@@](C)(C3=C)[C@@]1(CO)CCC(C)=C2

InChI

InChIKey=XARFTSXTPBVXCB-KJWHEZOQSA-N
InChI=1S/C15H22O3/c1-9-4-5-15(8-16)13(6-9)18-11-7-12(17)14(15,3)10(11)2/h6,11-13,16-17H,2,4-5,7-8H2,1,3H3/t11-,12-,13-,14-,15-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
12,13-DEOXYVERRUCAROL
Common Name English
TRICHOTHECA-9,12-DIENE-4,15-DIOL, (4.BETA.)-
Systematic Name English
(4.BETA.)-TRICHOTHECA-9,12-DIENE-4,15-DIOL
Systematic Name English
Code System Code Type Description
PUBCHEM
11054073
Created by admin on Fri Dec 15 17:00:39 GMT 2023 , Edited by admin on Fri Dec 15 17:00:39 GMT 2023
PRIMARY
FDA UNII
KD20049JC7
Created by admin on Fri Dec 15 17:00:39 GMT 2023 , Edited by admin on Fri Dec 15 17:00:39 GMT 2023
PRIMARY
CAS
63743-78-2
Created by admin on Fri Dec 15 17:00:39 GMT 2023 , Edited by admin on Fri Dec 15 17:00:39 GMT 2023
PRIMARY
NIH
NCATS
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