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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 of GINKGOLIDE J

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

Targets

Primary TargetPharmacologyConditionPotency
4.2 µM [IC50]
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
  • Download
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
Created by admin on Sat Jun 26 08:52:11 UTC 2021 , Edited by admin on Sat Jun 26 08:52:11 UTC 2021
PRIMARY
FDA UNII
M5297RI2UE
Created by admin on Sat Jun 26 08:52:11 UTC 2021 , Edited by admin on Sat Jun 26 08:52:11 UTC 2021
PRIMARY
DRUG BANK
DB06746
Created by admin on Sat Jun 26 08:52:11 UTC 2021 , Edited by admin on Sat Jun 26 08:52:11 UTC 2021
PRIMARY
PUBCHEM
11154476
Created by admin on Sat Jun 26 08:52:11 UTC 2021 , Edited by admin on Sat Jun 26 08:52:11 UTC 2021
PRIMARY
CAS
107438-79-9
Created by admin on Sat Jun 26 08:52:11 UTC 2021 , Edited by admin on Sat Jun 26 08:52:11 UTC 2021
PRIMARY
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