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Details

Stereochemistry ABSOLUTE
Molecular Formula C35H54O2
Molecular Weight 506.8021
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ERGOSTANOL BENZOATE

SMILES

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

InChI

InChIKey=QSHAZQWPTYSPBQ-GFKVJPSPSA-N
InChI=1S/C35H54O2/c1-23(2)24(3)12-13-25(4)30-16-17-31-29-15-14-27-22-28(37-33(36)26-10-8-7-9-11-26)18-20-34(27,5)32(29)19-21-35(30,31)6/h7-11,23-25,27-32H,12-22H2,1-6H3/t24-,25+,27-,28-,29-,30+,31-,32-,34-,35+/m0/s1

HIDE SMILES / InChI

Molecular Formula C35H54O2
Molecular Weight 506.8021
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 07:58:54 GMT 2023
Edited
by admin
on Sat Dec 16 07:58:54 GMT 2023
Record UNII
ULY64O130F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ERGOSTANOL BENZOATE
MI  
Systematic Name English
ERGOSTAN-3-OL, BENZOATE (3.BETA.,5.ALPHA.)-
Systematic Name English
ERGOSTANOL BENZOATE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m4985
Created by admin on Sat Dec 16 07:58:54 GMT 2023 , Edited by admin on Sat Dec 16 07:58:54 GMT 2023
PRIMARY Merck Index
CAS
6424-44-8
Created by admin on Sat Dec 16 07:58:54 GMT 2023 , Edited by admin on Sat Dec 16 07:58:54 GMT 2023
PRIMARY
FDA UNII
ULY64O130F
Created by admin on Sat Dec 16 07:58:54 GMT 2023 , Edited by admin on Sat Dec 16 07:58:54 GMT 2023
PRIMARY
PUBCHEM
67706220
Created by admin on Sat Dec 16 07:58:54 GMT 2023 , Edited by admin on Sat Dec 16 07:58:54 GMT 2023
PRIMARY