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Details

Stereochemistry ACHIRAL
Molecular Formula C28H18O14
Molecular Weight 578.4341
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of XANTHOFULVIN

SMILES

CC(=O)C1=C2OC3=CC(O)=C(O)C(C(O)=O)=C3C(=O)C2=CC(\C(O)=C4/COC5=CC(O)=C(O)C(C(O)=O)=C5C4=O)=C1C

InChI

InChIKey=VZJACTNXARYXEM-NHDPSOOVSA-N
InChI=1S/C28H18O14/c1-7-9(21(32)11-6-41-14-4-12(30)24(35)19(27(37)38)17(14)23(11)34)3-10-22(33)18-15(42-26(10)16(7)8(2)29)5-13(31)25(36)20(18)28(39)40/h3-5,30-32,35-36H,6H2,1-2H3,(H,37,38)(H,39,40)/b21-11-

HIDE SMILES / InChI

Molecular Formula C28H18O14
Molecular Weight 578.4341
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:47:41 GMT 2023
Edited
by admin
on Sat Dec 16 18:47:41 GMT 2023
Record UNII
32KP529UK8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XANTHOFULVIN
Common Name English
5-ACETYL-7-((5-CARBOXY-6,7-DIHYDROXY-4-OXO-2H-1-BENZOPYRAN-3(4H)-YLIDENE)HYDROXYMETHYL)-2,3-DIHYDROXY-6-METHYL-9-OXO-9H-XANTHENE-1-CARBOXYLIC ACID
Common Name English
9H-XANTHENE-1-CARBOXYLIC ACID, 5-ACETYL-7-((5-CARBOXY-6,7-DIHYDROXY-4-OXO-2H-1-BENZOPYRAN-3(4H)-YLIDENE)HYDROXYMETHYL)-2,3-DIHYDROXY-6-METHYL-9-OXO-
Common Name English
SPF 3059-1
Common Name English
SM 216289
Code English
Code System Code Type Description
PUBCHEM
9894470
Created by admin on Sat Dec 16 18:47:41 GMT 2023 , Edited by admin on Sat Dec 16 18:47:41 GMT 2023
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SMS_ID
300000024855
Created by admin on Sat Dec 16 18:47:41 GMT 2023 , Edited by admin on Sat Dec 16 18:47:41 GMT 2023
PRIMARY
CAS
151466-15-8
Created by admin on Sat Dec 16 18:47:41 GMT 2023 , Edited by admin on Sat Dec 16 18:47:41 GMT 2023
PRIMARY
FDA UNII
32KP529UK8
Created by admin on Sat Dec 16 18:47:41 GMT 2023 , Edited by admin on Sat Dec 16 18:47:41 GMT 2023
PRIMARY