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

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H24O2
Molecular Weight 236.3499
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HELMINTHOSPOROL

SMILES

[H][C@]1(CO)[C@]2([H])[C@H](CC[C@@]1(C)C(C)=C2C=O)C(C)C

InChI

InChIKey=JNDNSKMAFGPBFU-BEAPCOKYSA-N
InChI=1S/C15H24O2/c1-9(2)11-5-6-15(4)10(3)12(7-16)14(11)13(15)8-17/h7,9,11,13-14,17H,5-6,8H2,1-4H3/t11-,13+,14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H24O2
Molecular Weight 236.3499
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:32:36 GMT 2023
Edited
by admin
on Sat Dec 16 08:32:36 GMT 2023
Record UNII
7X0G04WG66
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HELMINTHOSPOROL
MI  
Common Name English
HELMINTHOSPOROL [MI]
Common Name English
BICYCLO(3.2.1)OCT-6-ENE-6-CARBOXALDEHYDE, 8-(HYDROXYMETHYL)-1,7-DIMETHYL-4-(1-METHYLETHYL)-, (1R,4R,5S,8S)-
Systematic Name English
Code System Code Type Description
FDA UNII
7X0G04WG66
Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023
PRIMARY
CAS
1619-29-0
Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023
PRIMARY
PUBCHEM
160583
Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID40936612
Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023
PRIMARY
MERCK INDEX
m754
Created by admin on Sat Dec 16 08:32:36 GMT 2023 , Edited by admin on Sat Dec 16 08:32:36 GMT 2023
PRIMARY Merck Index