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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H14O5
Molecular Weight 286.2794
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEMINIGERONE

SMILES

COC1=CC(OC)=C2C(O)=C3C(=O)C=C(C)OC3=CC2=C1

InChI

InChIKey=HFPQKJMLIONCGP-UHFFFAOYSA-N
InChI=1S/C16H14O5/c1-8-4-11(17)15-13(21-8)6-9-5-10(19-2)7-12(20-3)14(9)16(15)18/h4-7,18H,1-3H3

HIDE SMILES / InChI

Molecular Formula C16H14O5
Molecular Weight 286.2794
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:44:06 GMT 2023
Edited
by admin
on Fri Dec 15 19:44:06 GMT 2023
Record UNII
TLJ90R747F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEMINIGERONE
Common Name English
TMD-256A2
Code English
RUBROFUSARIN B
Common Name English
TMD 256A2
Code English
4H-NAPHTHO(2,3-B)PYRAN-4-ONE, 5-HYDROXY-6,8-DIMETHOXY-2-METHYL-
Systematic Name English
Code System Code Type Description
CAS
17276-15-2
Created by admin on Fri Dec 15 19:44:06 GMT 2023 , Edited by admin on Fri Dec 15 19:44:06 GMT 2023
PRIMARY
PUBCHEM
176918
Created by admin on Fri Dec 15 19:44:06 GMT 2023 , Edited by admin on Fri Dec 15 19:44:06 GMT 2023
PRIMARY
FDA UNII
TLJ90R747F
Created by admin on Fri Dec 15 19:44:06 GMT 2023 , Edited by admin on Fri Dec 15 19:44:06 GMT 2023
PRIMARY
CHEBI
133805
Created by admin on Fri Dec 15 19:44:06 GMT 2023 , Edited by admin on Fri Dec 15 19:44:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID50169393
Created by admin on Fri Dec 15 19:44:06 GMT 2023 , Edited by admin on Fri Dec 15 19:44:06 GMT 2023
PRIMARY
CHEBI
145920
Created by admin on Fri Dec 15 19:44:06 GMT 2023 , Edited by admin on Fri Dec 15 19:44:06 GMT 2023
PRIMARY