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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H44O2
Molecular Weight 436.6692
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DEHYDROERGOSTEROL ACETATE

SMILES

[H][C@@]1(CC[C@@]2([H])C3=CC=C4C[C@H](CC[C@]4(C)C3=CC[C@]12C)OC(C)=O)[C@H](C)\C=C\[C@H](C)C(C)C

InChI

InChIKey=USXNJOVHHSKEBV-RDQHZIOXSA-N
InChI=1S/C30H44O2/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/h8-11,15,19-21,24,26-27H,12-14,16-18H2,1-7H3/b9-8+/t20-,21+,24-,26+,27-,29-,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H44O2
Molecular Weight 436.6692
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 1
Optical Activity UNSPECIFIED

Dehydroergosterol acetate is ergosterol derivative that can be used in photochemical reactions.

Originator

Sources: achr. Ges. Wiss. Gottingen Math.-physik. Klasse (1931), 101-19.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Patents

Patents

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:23:19 GMT 2023
Edited
by admin
on Sat Dec 16 09:23:19 GMT 2023
Record UNII
H762V3R6G7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEHYDROERGOSTEROL ACETATE
MI  
Common Name English
DEHYDROERGOSTEROL ACETATE [MI]
Common Name English
ERGOSTA-5,7,9(11),22-TETRAEN-3-OL, 3-ACETATE, (3.BETA.,22E)-
Systematic Name English
Code System Code Type Description
MERCK INDEX
m4147
Created by admin on Sat Dec 16 09:23:19 GMT 2023 , Edited by admin on Sat Dec 16 09:23:19 GMT 2023
PRIMARY Merck Index
FDA UNII
H762V3R6G7
Created by admin on Sat Dec 16 09:23:19 GMT 2023 , Edited by admin on Sat Dec 16 09:23:19 GMT 2023
PRIMARY
CAS
1060-56-6
Created by admin on Sat Dec 16 09:23:19 GMT 2023 , Edited by admin on Sat Dec 16 09:23:19 GMT 2023
PRIMARY
PUBCHEM
69827569
Created by admin on Sat Dec 16 09:23:19 GMT 2023 , Edited by admin on Sat Dec 16 09:23:19 GMT 2023
PRIMARY