TRICHOTHECIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H24O5
Molecular Weight	332.3909
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@]12O[C@@H]3C[C@@H](OC(=O)\C=C/C)[C@@](C)([C@]34CO4)[C@@]1(C)CC(=O)C(C)=C2

InChI

InChIKey=LJWZOKOFCBPNAG-HULHSAFCSA-N

InChI=1S/C19H24O5/c1-5-6-16(21)24-14-8-15-19(10-22-19)18(14,4)17(3)9-12(20)11(2)7-13(17)23-15/h5-7,13-15H,8-10H2,1-4H3/b6-5-/t13-,14-,15-,17+,18-,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H24O5
Molecular Weight	332.3909
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 07:52:01 GMT 2023` Edited by `admin` on `Sat Dec 16 07:52:01 GMT 2023`
Record UNII	2GB7AS83GT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TRICHOTHECIN

Common Name

English

NSC-92492

Code

English

TRICHOTHEC-9-EN-8-ONE, 12,13-EPOXY-4-(((2Z)-1-OXO-2-BUTENYL)OXY)-, (4.BETA.)-

Systematic Name

English

TRICHOTHECIN [MI]

Common Name

English

(4.BETA.)-12,13-EPOXY-4-(((2Z)-1-OXO-2-BUTENYL)OXY)TRICHOTHEC-9-EN-8-ONE

Systematic Name

English

Code System Code Type Description

FDA UNII

2GB7AS83GT