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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H30O10
Molecular Weight 469.4968
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7,7,8-TRIDEUTERIONEOSOLANIOL DIACETATE

SMILES

[2H]C1([2H])[C@]([2H])(OC(C)=O)C(C)=C[C@H]2O[C@@H]3[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@](C)([C@]34CO4)[C@@]12COC(C)=O

InChI

InChIKey=GSLBJZJTYRGQOS-KJGPIUMUSA-N
InChI=1S/C23H30O10/c1-11-7-17-22(9-28-12(2)24,8-16(11)30-13(3)25)21(6)19(32-15(5)27)18(31-14(4)26)20(33-17)23(21)10-29-23/h7,16-20H,8-10H2,1-6H3/t16-,17+,18+,19+,20+,21+,22+,23-/m0/s1/i8D2,16D

HIDE SMILES / InChI

Approval Year

Name Type Language
7,7,8-TRIDEUTERIONEOSOLANIOL DIACETATE
Common Name English
7,7,8-TRIDEUTERIO TOXIN T-2 TETRAOL TETRAACETATE
Preferred Name English
TRICHOTHEC-9-ENE-7,7,8-D3-3,4,8,15-TETROL, 12,13-EPOXY-, TETRAACETATE, (3.ALPHA.,4.BETA.,8.ALPHA.)-
Common Name English
7,7,8-TRIDEUTERIODIACETYLNEOSOLANIOL
Common Name English
Code System Code Type Description
CAS
112818-29-8
Created by admin on Tue Apr 01 22:17:32 GMT 2025 , Edited by admin on Tue Apr 01 22:17:32 GMT 2025
PRIMARY
FDA UNII
WVW3K98SGZ
Created by admin on Tue Apr 01 22:17:32 GMT 2025 , Edited by admin on Tue Apr 01 22:17:32 GMT 2025
PRIMARY
PUBCHEM
13992159
Created by admin on Tue Apr 01 22:17:32 GMT 2025 , Edited by admin on Tue Apr 01 22:17:32 GMT 2025
PRIMARY