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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H22O10
Molecular Weight 542.4897
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RUGULOSIN A

SMILES

CC1=CC(O)=C2C(=O)C3=C(O)[C@H]4[C@@H](O)[C@@H]5[C@H]6[C@H](O)[C@H](C(O)=C7C(=O)C8=C(O)C=C(C)C=C8C(=O)[C@]467)[C@]35C(=O)C2=C1

InChI

InChIKey=OYNIPTDPTUSUAY-HJCFMKLBSA-N
InChI=1S/C30H22O10/c1-7-3-9-13(11(31)5-7)21(33)17-25(37)20-23(35)15-16-24(36)19(29(15,17)27(9)39)26(38)18-22(34)14-10(28(40)30(16,18)20)4-8(2)6-12(14)32/h3-6,15-16,19-20,23-24,31-32,35-38H,1-2H3/t15-,16-,19+,20?,23-,24-,29+,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H22O10
Molecular Weight 542.4897
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:36:05 GMT 2025
Edited
by admin
on Mon Mar 31 22:36:05 GMT 2025
Record UNII
7020AB775D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RUGULOSIN A
Common Name English
NSC-160880
Preferred Name English
5H,6H-6,13A,5A,14-(1,2,3,4-BUTANETETRAYLCYCLOOCTA(1,2-B:5,6-B')DINAPHTHALENE-5,8,13,16(14H)-TETRONE, 1,7,9,15,17,20-HEXAHYDROXY-3,11-DIMETHYL-, (5AS,6R,13AS,14R,17S,18R,19R,20S)-
Systematic Name English
(+)-RUGULOSIN
Common Name English
NSC-249990
Code English
RUGULOSIN [IARC]
Common Name English
Code System Code Type Description
NSC
160880
Created by admin on Mon Mar 31 22:36:05 GMT 2025 , Edited by admin on Mon Mar 31 22:36:05 GMT 2025
PRIMARY
NSC
249990
Created by admin on Mon Mar 31 22:36:05 GMT 2025 , Edited by admin on Mon Mar 31 22:36:05 GMT 2025
PRIMARY
FDA UNII
7020AB775D
Created by admin on Mon Mar 31 22:36:05 GMT 2025 , Edited by admin on Mon Mar 31 22:36:05 GMT 2025
PRIMARY
CAS
23537-16-8
Created by admin on Mon Mar 31 22:36:05 GMT 2025 , Edited by admin on Mon Mar 31 22:36:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID40891838
Created by admin on Mon Mar 31 22:36:05 GMT 2025 , Edited by admin on Mon Mar 31 22:36:05 GMT 2025
PRIMARY