7,7,8-TRIDEUTERIONEOSOLANIOL DIACETATE

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

Structure Search

SMILES

[H][C@@]12O[C@]3([H])C=C(C)[C@@]([2H])(OC(C)=O)C([2H])([2H])[C@]3(COC(C)=O)[C@@](C)([C@H](OC(C)=O)[C@H]1OC(C)=O)[C@]24CO4

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

Molecular Formula	C23H30O10
Molecular Weight	469.4968
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 14:08:09 GMT 2023` Edited by `admin` on `Sat Dec 16 14:08:09 GMT 2023`
Record UNII	WVW3K98SGZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7,7,8-TRIDEUTERIONEOSOLANIOL DIACETATE

Common 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-TRIDEUTERIO TOXIN T-2 TETRAOL TETRAACETATE

Common Name

English

7,7,8-TRIDEUTERIODIACETYLNEOSOLANIOL

Common Name

English

Code System Code Type Description

CAS

112818-29-8

Created by admin on Sat Dec 16 14:08:09 GMT 2023 , Edited by admin on Sat Dec 16 14:08:09 GMT 2023

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FDA UNII

WVW3K98SGZ

Created by admin on Sat Dec 16 14:08:09 GMT 2023 , Edited by admin on Sat Dec 16 14:08:09 GMT 2023

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PUBCHEM

13992159

Created by admin on Sat Dec 16 14:08:09 GMT 2023 , Edited by admin on Sat Dec 16 14:08:09 GMT 2023

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