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Details

Stereochemistry UNKNOWN
Molecular Formula C15H14O7
Molecular Weight 306.2675
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NOVARUBIN

SMILES

COC1=C(O)C2=C(C(=O)C=C(C(CO)C(C)=O)C2=O)C(O)=C1

InChI

InChIKey=FRMFORADSNGXNE-UHFFFAOYSA-N
InChI=1S/C15H14O7/c1-6(17)8(5-16)7-3-9(18)12-10(19)4-11(22-2)15(21)13(12)14(7)20/h3-4,8,16,19,21H,5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C15H14O7
Molecular Weight 306.2675
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:51:01 GMT 2025
Edited
by admin
on Tue Apr 01 19:51:01 GMT 2025
Record UNII
DVQ83912J4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROXYMETHYLDEMETHYLJAVANICIN
Preferred Name English
NOVARUBIN
Common Name English
1,4-NAPHTHOQUINONE, 5,8-DIHYDROXY-2-(1-(HYDROXYMETHYL)ACETONYL)-7-METHOXY-
Systematic Name English
1,4-NAPHTHALENEDIONE, 5,8-DIHYDROXY-2-(1-(HYDROXYMETHYL)-2-OXOPROPYL)-7-METHOXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
122201354
Created by admin on Tue Apr 01 19:51:01 GMT 2025 , Edited by admin on Tue Apr 01 19:51:01 GMT 2025
PRIMARY
FDA UNII
DVQ83912J4
Created by admin on Tue Apr 01 19:51:01 GMT 2025 , Edited by admin on Tue Apr 01 19:51:01 GMT 2025
PRIMARY
CAS
18885-49-9
Created by admin on Tue Apr 01 19:51:01 GMT 2025 , Edited by admin on Tue Apr 01 19:51:01 GMT 2025
PRIMARY