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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H34O10
Molecular Weight 482.5208
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3'-HYDROXY HT-2 TOXIN 3-ACETATE

SMILES

[H][C@@]12O[C@]3([H])C=C(C)[C@H](C[C@]3(COC(C)=O)[C@@](C)([C@H](O)[C@H]1OC(C)=O)[C@]24CO4)OC(=O)CC(C)(C)O

InChI

InChIKey=FOHUQNSVOKPYSD-GGTUAJKXSA-N
InChI=1S/C24H34O10/c1-12-7-16-23(10-30-13(2)25,8-15(12)33-17(27)9-21(4,5)29)22(6)19(28)18(32-14(3)26)20(34-16)24(22)11-31-24/h7,15-16,18-20,28-29H,8-11H2,1-6H3/t15-,16+,18+,19+,20+,22+,23+,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H34O10
Molecular Weight 482.5208
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:02:43 GMT 2023
Edited
by admin
on Sat Dec 16 08:02:43 GMT 2023
Record UNII
X1TCS0QD64
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3'-HYDROXY HT-2 TOXIN 3-ACETATE
Common Name English
ISO-TC-1
Common Name English
TRICHOTHEC-9-ENE-3,4,8,15-TETROL, 12,13-EPOXY-, 3,15-DIACETATE 8-(3-HYDROXY-3-METHYLBUTANOATE), (3.ALPHA.,4.BETA.,8.ALPHA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
X1TCS0QD64
Created by admin on Sat Dec 16 08:02:43 GMT 2023 , Edited by admin on Sat Dec 16 08:02:43 GMT 2023
PRIMARY
EPA CompTox
DTXSID70905730
Created by admin on Sat Dec 16 08:02:43 GMT 2023 , Edited by admin on Sat Dec 16 08:02:43 GMT 2023
PRIMARY
PUBCHEM
121596641
Created by admin on Sat Dec 16 08:02:43 GMT 2023 , Edited by admin on Sat Dec 16 08:02:43 GMT 2023
PRIMARY
CAS
100762-36-5
Created by admin on Sat Dec 16 08:02:43 GMT 2023 , Edited by admin on Sat Dec 16 08:02:43 GMT 2023
PRIMARY
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