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

Details

Stereochemistry ABSOLUTE
Molecular Formula C44H78O2
Molecular Weight 639.0889
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CAMPESTERYL PALMITATE

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)CCCCCCCCCCCCCCC)[C@H](C)CC[C@@H](C)C(C)C

InChI

InChIKey=BHGYUIZFHKUJAB-ZBGFAQEVSA-N
InChI=1S/C44H78O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-42(45)46-37-28-30-43(6)36(32-37)24-25-38-40-27-26-39(44(40,7)31-29-41(38)43)35(5)23-22-34(4)33(2)3/h24,33-35,37-41H,8-23,25-32H2,1-7H3/t34-,35-,37+,38+,39-,40+,41+,43+,44-/m1/s1

HIDE SMILES / InChI

Molecular Formula C44H78O2
Molecular Weight 639.0889
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:47:45 GMT 2023
Edited
by admin
on Sat Dec 16 11:47:45 GMT 2023
Record UNII
3H3RLE97D6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CAMPESTERYL PALMITATE
Common Name English
CAMPESTEROL PALMITATE
Common Name English
ERGOST-5-EN-3-OL, 3-HEXADECANOATE, (3.BETA.,24R)-
Systematic Name English
Code System Code Type Description
CAS
74240-46-3
Created by admin on Sat Dec 16 11:47:45 GMT 2023 , Edited by admin on Sat Dec 16 11:47:45 GMT 2023
PRIMARY
FDA UNII
3H3RLE97D6
Created by admin on Sat Dec 16 11:47:45 GMT 2023 , Edited by admin on Sat Dec 16 11:47:45 GMT 2023
PRIMARY
PUBCHEM
13747841
Created by admin on Sat Dec 16 11:47:45 GMT 2023 , Edited by admin on Sat Dec 16 11:47:45 GMT 2023
PRIMARY