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

Details

Stereochemistry UNKNOWN
Molecular Formula C15H16O8
Molecular Weight 324.2827
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDROXYDIHYDROFUSARUBIN

SMILES

COC1=C(O)C2=C(C(O)=C1)C(=O)[C@]3(O)COC(C)(O)CC3C2=O

InChI

InChIKey=RKILODOPILZBRZ-PTFUMTAGSA-N
InChI=1S/C15H16O8/c1-14(20)4-6-11(17)10-9(13(19)15(6,21)5-23-14)7(16)3-8(22-2)12(10)18/h3,6,16,18,20-21H,4-5H2,1-2H3/t6?,14?,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H16O8
Molecular Weight 324.2827
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 1 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:01:46 GMT 2023
Edited
by admin
on Sat Dec 16 11:01:46 GMT 2023
Record UNII
730XL60PZM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROXYDIHYDROFUSARUBIN
Common Name English
1H-NAPHTHO(2,3-C)PYRAN-5,10-DIONE, 3,4,4A,10A-TETRAHYDRO-3,6,9,10A-TETRAHYDROXY-7-METHOXY-3-METHYL-
Systematic Name English
Code System Code Type Description
CAS
71724-92-0
Created by admin on Sat Dec 16 11:01:46 GMT 2023 , Edited by admin on Sat Dec 16 11:01:46 GMT 2023
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PUBCHEM
145721955
Created by admin on Sat Dec 16 11:01:46 GMT 2023 , Edited by admin on Sat Dec 16 11:01:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID40992339
Created by admin on Sat Dec 16 11:01:46 GMT 2023 , Edited by admin on Sat Dec 16 11:01:46 GMT 2023
PRIMARY
FDA UNII
730XL60PZM
Created by admin on Sat Dec 16 11:01:46 GMT 2023 , Edited by admin on Sat Dec 16 11:01:46 GMT 2023
PRIMARY