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

Details

Stereochemistry ABSOLUTE
Molecular Formula C30H18O10
Molecular Weight 538.4579
Optical Activity NONE
Additional Stereochemistry Yes
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0
Stereo Comments AXIAL, S

SHOW SMILES / InChI
Structure of SKYRIN

SMILES

CC1=CC2=C(C(O)=C1)C(=O)C3=C(O)C=C(O)C(C4=C5C(=O)C6=C(C(O)=CC(C)=C6)C(=O)C5=C(O)C=C4O)=C3C2=O

InChI

InChIKey=MQSXZQXHIJMNAF-UHFFFAOYSA-N
InChI=1S/C30H18O10/c1-9-3-11-19(13(31)5-9)29(39)23-17(35)7-15(33)21(25(23)27(11)37)22-16(34)8-18(36)24-26(22)28(38)12-4-10(2)6-14(32)20(12)30(24)40/h3-8,31-36H,1-2H3

HIDE SMILES / InChI

Molecular Formula C30H18O10
Molecular Weight 538.4579
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 Sat Dec 16 08:57:02 GMT 2023
Edited
by admin
on Sat Dec 16 08:57:02 GMT 2023
Record UNII
VLA1F42GXP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SKYRIN
Common Name English
ENDOTHIANIN
Common Name English
NSC-361128
Code English
(1,1'-BIANTHRACENE)-9,9',10,10'-TETRONE, 2,2',4,4',5,5'-HEXAHYDROXY-7,7'-DIMETHYL-, (S)-
Systematic Name English
SKIRIN
Common Name English
RHODOPHYSCIN
Common Name English
(+)-S-SKYRIN
Common Name English
Code System Code Type Description
FDA UNII
VLA1F42GXP
Created by admin on Sat Dec 16 08:57:02 GMT 2023 , Edited by admin on Sat Dec 16 08:57:02 GMT 2023
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NSC
361128
Created by admin on Sat Dec 16 08:57:02 GMT 2023 , Edited by admin on Sat Dec 16 08:57:02 GMT 2023
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EPA CompTox
DTXSID00208943
Created by admin on Sat Dec 16 08:57:02 GMT 2023 , Edited by admin on Sat Dec 16 08:57:02 GMT 2023
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PUBCHEM
73071
Created by admin on Sat Dec 16 08:57:02 GMT 2023 , Edited by admin on Sat Dec 16 08:57:02 GMT 2023
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CAS
602-06-2
Created by admin on Sat Dec 16 08:57:02 GMT 2023 , Edited by admin on Sat Dec 16 08:57:02 GMT 2023
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