VERROL

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H30O6
Molecular Weight	378.4593
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C[C@@H](O)[C@@](C)([C@]13CO3)[C@@]4(COC(=O)\C=C(/C)CCO)CCC(C)=C[C@@]4([H])O2

InChI

InChIKey=PZTXWUDHQJHJOJ-LJQLBOGDSA-N

InChI=1S/C21H30O6/c1-13-4-6-20(11-25-18(24)9-14(2)5-7-22)16(8-13)27-17-10-15(23)19(20,3)21(17)12-26-21/h8-9,15-17,22-23H,4-7,10-12H2,1-3H3/b14-9+/t15-,16-,17-,19-,20-,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H30O6
Molecular Weight	378.4593
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 06:42:34 GMT 2023` Edited by `admin` on `Sat Dec 16 06:42:34 GMT 2023`
Record UNII	A8HAX7VGF3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VERROL

Common Name

English

TRICHOTHEC-9-ENE-4,15-DIOL, 12,13-EPOXY-, 15-((2E)-5-HYDROXY-3-METHYL-2-PENTENOATE), (4.BETA.)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

6440745

Created by admin on Sat Dec 16 06:42:34 GMT 2023 , Edited by admin on Sat Dec 16 06:42:34 GMT 2023

PRIMARY

FDA UNII

A8HAX7VGF3

Created by admin on Sat Dec 16 06:42:34 GMT 2023 , Edited by admin on Sat Dec 16 06:42:34 GMT 2023

PRIMARY

CAS

84412-91-9

Created by admin on Sat Dec 16 06:42:34 GMT 2023 , Edited by admin on Sat Dec 16 06:42:34 GMT 2023

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