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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H50O2
Molecular Weight 442.7168
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-ERGOSTENOL ACETATE

SMILES

[H][C@@]1(CCC2=C3CC[C@@]4([H])C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(C)=O)[C@H](C)CC[C@H](C)C(C)C

InChI

InChIKey=LALAQRGFSWBMHR-VHEPHSCYSA-N
InChI=1S/C30H50O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h19-21,23-24,26,28H,8-18H2,1-7H3/t20-,21+,23-,24-,26+,28-,29-,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H50O2
Molecular Weight 442.7168
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:01:25 GMT 2023
Edited
by admin
on Sat Dec 16 10:01:25 GMT 2023
Record UNII
ND0BI9693K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-ERGOSTENOL ACETATE
MI  
Common Name English
ERGOST-8(14)-EN-3-OL, 3-ACETATE, (3.BETA.,5.ALPHA.)-
Systematic Name English
NSC-94753
Code English
3.BETA.-ACETOXYERGOST-8(14)-ENE
Systematic Name English
(3.BETA.,5.ALPHA.)-ERGOST-8(14)-EN-3-OL, ACETATE
Systematic Name English
.ALPHA.-ERGOSTENOL ACETATE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m719
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID30960820
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY
NSC
94753
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY
CAS
4042-95-9
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY
PUBCHEM
21139931
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY
FDA UNII
ND0BI9693K
Created by admin on Sat Dec 16 10:01:25 GMT 2023 , Edited by admin on Sat Dec 16 10:01:25 GMT 2023
PRIMARY