GINKGOLIDE J

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H24O10
Molecular Weight	424.3993
Optical Activity	UNSPECIFIED
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@]1([H])C(=O)O[C@@]2([H])C[C@]34[C@@]5([H])[C@@]([H])([C@@]([H])(C(C)(C)C)[C@]64[C@]([H])(C(=O)O[C@@]6([H])O[C@@]3(C(=O)O5)[C@@]12O)O)O

InChI

InChIKey=LMEHVEUFNRJAAV-UKWFQYJJSA-N

InChI=1S/C20H24O10/c1-6-12(23)27-7-5-17-11-8(21)9(16(2,3)4)18(17)10(22)13(24)29-15(18)30-20(17,14(25)28-11)19(6,7)26/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8-,9+,10+,11-,15+,17-,18+,19-,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C20H24O10
Molecular Weight	424.3993
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Glycine receptor subunit alpha-1 24 Target ID: CHEMBL5845 Sources: https://www.ncbi.nlm.nih.gov/pubmed/17352465	Antagonist 2575		4.2 µM [IC50]
neuron apoptotic process 5 Target ID: GO:0051402 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10079019	Inhibitor 7728

Substance Class	Chemical Created by `admin` on `Sat Jun 26 08:52:11 UTC 2021` Edited by `admin` on `Sat Jun 26 08:52:11 UTC 2021`
Record UNII	M5297RI2UE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GINKGOLIDE J

Common Name

English

BN-52024

Code

English

GINKGOLIDE A, 7-HYDROXY-, (7.BETA.)-

Common Name

English

GINKGOLIDE J (CONSTITUENT OF GINKGO) [DSC]

Common Name

English

9H-1,7A-(EPOXYMETHANO)-1H,6AH-CYCLOPENTA(C)FURO(2,3-B)FURO(3',2':3,4)CYCLOPENTA(1,2-D)FURAN-5,9,12(4H)-TRIONE, 3-(1,1-DIMETHYLETHYL)HEXAHYDRO-2,4,7B-TRIHYDROXY-8-METHYL-, (1S,2R,3S,3AS,4R,6AR,7AR,7BR,8S,10AS,11AS)-

Common Name

English

Code System Code Type Description

EVMPD

SUB184980