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

Details

Stereochemistry ABSOLUTE
Molecular Formula C38H56O4
Molecular Weight 576.8488
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CAMPESTERYL FERULATE

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)\C=C\C5=CC(OC)=C(O)C=C5)[C@H](C)CC[C@@H](C)C(C)C

InChI

InChIKey=SWIWTAJTJOYCTB-NMYXBGBTSA-N
InChI=1S/C38H56O4/c1-24(2)25(3)8-9-26(4)31-14-15-32-30-13-12-28-23-29(18-20-37(28,5)33(30)19-21-38(31,32)6)42-36(40)17-11-27-10-16-34(39)35(22-27)41-7/h10-12,16-17,22,24-26,29-33,39H,8-9,13-15,18-21,23H2,1-7H3/b17-11+/t25-,26-,29+,30+,31-,32+,33+,37+,38-/m1/s1

HIDE SMILES / InChI

Molecular Formula C38H56O4
Molecular Weight 576.8488
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:32:09 GMT 2023
Edited
by admin
on Sat Dec 16 09:32:09 GMT 2023
Record UNII
8BZA1H952Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CAMPESTERYL FERULATE
Common Name English
ERGOST-5-EN-3-OL, 3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOATE, (3.BETA.,24R)-
Systematic Name English
CAMPESTEROL FERULIC ACID ESTER
Common Name English
ERGOST-5-EN-3.BETA.-OL, 4-HYDROXY-3-METHOXYCINNAMATE, (24R)-
Systematic Name English
CAMPESTEROL FERULATE
Common Name English
CINNAMIC ACID, 4-HYDROXY-3-METHOXY-, ERGOST-5-EN-3.BETA.-YL ESTER, (24R)-
Common Name English
Code System Code Type Description
CAS
20972-07-0
Created by admin on Sat Dec 16 09:32:09 GMT 2023 , Edited by admin on Sat Dec 16 09:32:09 GMT 2023
PRIMARY
FDA UNII
8BZA1H952Q
Created by admin on Sat Dec 16 09:32:09 GMT 2023 , Edited by admin on Sat Dec 16 09:32:09 GMT 2023
PRIMARY
EPA CompTox
DTXSID30872333
Created by admin on Sat Dec 16 09:32:09 GMT 2023 , Edited by admin on Sat Dec 16 09:32:09 GMT 2023
PRIMARY
PUBCHEM
15056832
Created by admin on Sat Dec 16 09:32:09 GMT 2023 , Edited by admin on Sat Dec 16 09:32:09 GMT 2023
PRIMARY