Ovalicin

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C16H24O5
Molecular Weight	296.3588
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@@H]1C(=O)CC[C@]2(CO2)[C@@]1(O)[C@@]3(C)O[C@@H]3CC=C(C)C

InChI

InChIKey=NESRXFGQJARQNM-OWYFMNJBSA-N

InChI=1S/C16H24O5/c1-10(2)5-6-12-14(3,21-12)16(18)13(19-4)11(17)7-8-15(16)9-20-15/h5,12-13,18H,6-9H2,1-4H3/t12-,13-,14+,15+,16+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C16H24O5
Molecular Weight	296.3588
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:01:25 GMT 2023` Edited by `admin` on `Sat Dec 16 20:01:25 GMT 2023`
Record UNII	XBF6GMZ9TW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Ovalicin

Official Name

English

1-Oxaspiro[2.5]octan-6-one, 4-hydroxy-5-methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)-2-oxiranyl]-, (3S,4R,5S)-

Systematic Name

English

1-Oxaspiro[2.5]octan-6-one, 4-(1,2-epoxy-1,5-dimethyl-4-hexenyl)-4-hydroxy-5-methoxy-, (1S,2R,3S,4R,5S)-(-)-

Systematic Name

English

(-)-Ovalicin

Common Name

English

1-Oxaspiro[2.5]octan-6-one, 4-hydroxy-5-methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-butenyl)oxiranyl]-, (3S,4R,5S)-

Systematic Name

English

(3S,4R,5S)-4-Hydroxy-5-methoxy-4-[(2S,3R)-2-methyl-3-(3-methyl-2-buten-1-yl)-2-oxiranyl]-1-oxaspiro[2.5]octan-6-one

Systematic Name

English

Graphinone

Common Name

English

Code System Code Type Description

PUBCHEM

10957430

Created by admin on Sat Dec 16 20:01:25 GMT 2023 , Edited by admin on Sat Dec 16 20:01:25 GMT 2023

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FDA UNII

XBF6GMZ9TW

Created by admin on Sat Dec 16 20:01:25 GMT 2023 , Edited by admin on Sat Dec 16 20:01:25 GMT 2023

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EPA CompTox

DTXSID40941443

Created by admin on Sat Dec 16 20:01:25 GMT 2023 , Edited by admin on Sat Dec 16 20:01:25 GMT 2023

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CAS

19683-98-8

Created by admin on Sat Dec 16 20:01:25 GMT 2023 , Edited by admin on Sat Dec 16 20:01:25 GMT 2023

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