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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O5
Molecular Weight 282.3322
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SCIRPENOL

SMILES

CC1=C[C@H]2O[C@@H]3[C@H](O)[C@@H](O)[C@@](C)([C@]34CO4)[C@@]2(CO)CC1

InChI

InChIKey=PXEBOIUZEXXBGH-HRJXPNSYSA-N
InChI=1S/C15H22O5/c1-8-3-4-14(6-16)9(5-8)20-12-10(17)11(18)13(14,2)15(12)7-19-15/h5,9-12,16-18H,3-4,6-7H2,1-2H3/t9-,10-,11-,12-,13-,14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H22O5
Molecular Weight 282.3322
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:56:44 GMT 2025
Edited
by admin
on Mon Mar 31 19:56:44 GMT 2025
Record UNII
YDE8TG6S26
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-269142
Preferred Name English
SCIRPENOL
Common Name English
TRICHOTHEC-9-ENE-3,4,15-TRIOL, 12,13-EPOXY-, (3.ALPHA.,4.BETA.)-
Common Name English
SCIRPENETRIOL
Common Name English
SCIRP-9-ENE-3.ALPHA.,4.BETA.,15-TRIOL
Common Name English
SCIRPENTRIOL
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID301017522
Created by admin on Mon Mar 31 19:56:44 GMT 2025 , Edited by admin on Mon Mar 31 19:56:44 GMT 2025
PRIMARY
FDA UNII
YDE8TG6S26
Created by admin on Mon Mar 31 19:56:44 GMT 2025 , Edited by admin on Mon Mar 31 19:56:44 GMT 2025
PRIMARY
CAS
2270-41-9
Created by admin on Mon Mar 31 19:56:44 GMT 2025 , Edited by admin on Mon Mar 31 19:56:44 GMT 2025
PRIMARY
PUBCHEM
15571724
Created by admin on Mon Mar 31 19:56:44 GMT 2025 , Edited by admin on Mon Mar 31 19:56:44 GMT 2025
PRIMARY
NSC
269142
Created by admin on Mon Mar 31 19:56:44 GMT 2025 , Edited by admin on Mon Mar 31 19:56:44 GMT 2025
PRIMARY