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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H22O7
Molecular Weight 362.3738
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NAGILACTONE C

SMILES

CC(C)C1=C2[C@@H](O)[C@H]3OC(=O)[C@]4(C)[C@H]3[C@](C)([C@@H]5O[C@@H]5[C@@H]4O)C2=CC(=O)O1

InChI

InChIKey=DGNOPGIIPQKNHD-RSKPZANQSA-N
InChI=1S/C19H22O7/c1-6(2)11-9-7(5-8(20)24-11)18(3)14-12(10(9)21)26-17(23)19(14,4)15(22)13-16(18)25-13/h5-6,10,12-16,21-22H,1-4H3/t10-,12-,13-,14-,15+,16-,18-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H22O7
Molecular Weight 362.3738
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 23:39:53 GMT 2025
Edited
by admin
on Mon Mar 31 23:39:53 GMT 2025
Record UNII
38MVA8L9PT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NAGILACTONE C
Common Name English
NSC-117884
Preferred Name English
(1aR,2R,2aR,4aS,4bR,5R,9bS,9cS)-1a,2,2a,4a,4b,5,9b,9c-Octahydro-2,5-dihydroxy-2a,9b-dimethyl-6-(1-methylethyl)-3H,8H-furo[2?,3?,4?:4,5]oxireno[7,8]naphtho[2,1-c]pyran-3,8-dione
Systematic Name English
3H,8H-Furo[2?,3?,4?:4,5]oxireno[7,8]naphtho[2,1-c]pyran-3,8-dione, 1a,2,2a,4a,4b,5,9b,9c-octahydro-2,5-dihydroxy-2a,9b-dimethyl-6-(1-methylethyl)-, (1aR,2R,2aR,4aS,4bR,5R,9bS,9cS)-
Systematic Name English
3H,8H-Furo[2?,3?,4?:4,5]oxireno[7,8]naphtho[2,1-c]pyran-3,8-dione, 1a?,2,2a,4a?,4b?,5,9b,9c?-octahydro-2?,5?-dihydroxy-6-isopropyl-2a?,9b?-dimethyl- (8CI) Podolactone B, 7,8-deepoxy-8,14-didehydro-15,16-dideoxy-7-hydroxy-, (1?,2?,7?)-
Systematic Name English
NSC-211500
Code English
Code System Code Type Description
PUBCHEM
72505
Created by admin on Mon Mar 31 23:39:53 GMT 2025 , Edited by admin on Mon Mar 31 23:39:53 GMT 2025
PRIMARY
EPA CompTox
DTXSID401019971
Created by admin on Mon Mar 31 23:39:53 GMT 2025 , Edited by admin on Mon Mar 31 23:39:53 GMT 2025
PRIMARY
NSC
211500
Created by admin on Mon Mar 31 23:39:53 GMT 2025 , Edited by admin on Mon Mar 31 23:39:53 GMT 2025
PRIMARY
CAS
24338-53-2
Created by admin on Mon Mar 31 23:39:53 GMT 2025 , Edited by admin on Mon Mar 31 23:39:53 GMT 2025
PRIMARY
FDA UNII
38MVA8L9PT
Created by admin on Mon Mar 31 23:39:53 GMT 2025 , Edited by admin on Mon Mar 31 23:39:53 GMT 2025
PRIMARY
NSC
117884
Created by admin on Mon Mar 31 23:39:53 GMT 2025 , Edited by admin on Mon Mar 31 23:39:53 GMT 2025
PRIMARY