U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24O5
Molecular Weight 332.3909
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GIBBERELLIN A4

SMILES

[H][C@@]12CC[C@@H]3C[C@]1(CC3=C)[C@@H](C(O)=O)[C@]4([H])[C@@]5(C)[C@@H](O)CC[C@@]24OC5=O

InChI

InChIKey=RSQSQJNRHICNNH-NFMPGMCNSA-N
InChI=1S/C19H24O5/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12+,13-,14-,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 7 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:21:46 GMT 2023
Edited
by admin
on Sat Dec 16 12:21:46 GMT 2023
Record UNII
1360M56KLC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GIBBERELLIN A4
Common Name English
GIBBANE-1,10-DICARBOXYLIC ACID, 2,4A-DIHYDROXY-1-METHYL-8-METHYLENE-, 1,4A-LACTONE, (1.ALPHA.,2.BETA.,4A.ALPHA.,4B.BETA.,10.BETA.)-
Systematic Name English
4A.ALPHA.,4B.BETA.-GIBBANE-1.ALPHA.,10.BETA.-DICARBOXYLIC ACID, 2.BETA.,4A-DIHYDROXY-1-METHYL-8-METHYLENE-, 1,4A-LACTONE
Systematic Name English
GA4
Common Name English
Code System Code Type Description
CHEBI
32902
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY
CHEBI
73251
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY
FDA UNII
1360M56KLC
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY
PUBCHEM
92109
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY
DRUG BANK
DB07815
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID20896861
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-406-9
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY
CAS
468-44-0
Created by admin on Sat Dec 16 12:21:46 GMT 2023 , Edited by admin on Sat Dec 16 12:21:46 GMT 2023
PRIMARY