DEOXYNIVALENOL 3-O-HEMISUCCINATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H24O9
Molecular Weight	396.3885
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEOXYNIVALENOL 3-O-HEMISUCCINATE

Structure Search

SMILES

[H][C@@]12O[C@]3([H])C=C(C)C(=O)[C@@H](O)[C@]3(CO)[C@@](C)(C[C@H]1OC(=O)CCC(O)=O)[C@]24CO4

InChI

InChIKey=WJPZNYMEJSKXHL-ONXFTPPRSA-N

InChI=1S/C19H24O9/c1-9-5-11-18(7-20,15(25)14(9)24)17(2)6-10(16(28-11)19(17)8-26-19)27-13(23)4-3-12(21)22/h5,10-11,15-16,20,25H,3-4,6-8H2,1-2H3,(H,21,22)/t10-,11-,15-,16-,17-,18-,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H24O9
Molecular Weight	396.3885
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 `Sat Dec 16 08:16:23 GMT 2023` Edited by `admin` on `Sat Dec 16 08:16:23 GMT 2023`
Record UNII	09IUS7GFL0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEOXYNIVALENOL 3-O-HEMISUCCINATE

Common Name

English

VOMITOXIN 3-O-HEMISUCCINATE

Common Name

English

TRICHOTHEC-9-EN-8-ONE, 3-(3-CARBOXY-1-OXOPROPOXY)-12,13-EPOXY-7,15-DIHYDROXY-, (3.ALPHA.,7.ALPHA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

121231136

Created by admin on Sat Dec 16 08:16:23 GMT 2023 , Edited by admin on Sat Dec 16 08:16:23 GMT 2023

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CAS

113507-96-3

Created by admin on Sat Dec 16 08:16:23 GMT 2023 , Edited by admin on Sat Dec 16 08:16:23 GMT 2023

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FDA UNII

09IUS7GFL0

Created by admin on Sat Dec 16 08:16:23 GMT 2023 , Edited by admin on Sat Dec 16 08:16:23 GMT 2023

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EPA CompTox

DTXSID20921086

Created by admin on Sat Dec 16 08:16:23 GMT 2023 , Edited by admin on Sat Dec 16 08:16:23 GMT 2023

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