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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H50O2
Molecular Weight 442.7168
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FARADIOL

SMILES

[H][C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)C[C@H](O)[C@@]5(C)CC=C(C)[C@@H](C)[C@]25[H]

InChI

InChIKey=BNHIQKVOPNHQKO-IMLFCHQCSA-N
InChI=1S/C30H50O2/c1-18-11-14-28(6)24(32)17-30(8)20(25(28)19(18)2)9-10-22-27(5)15-13-23(31)26(3,4)21(27)12-16-29(22,30)7/h11,19-25,31-32H,9-10,12-17H2,1-8H3/t19-,20-,21+,22-,23+,24+,25-,27+,28-,29-,30-/m1/s1

HIDE SMILES / InChI

Molecular Formula C30H50O2
Molecular Weight 442.7168
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 11
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Inhibitory effects of triterpenoids and sterols on human immunodeficiency virus-1 reverse transcriptase.
2001 May
Antitubercular activity of triterpenoids from Asteraceae flowers.
2005 Jan
Substance Class Chemical
Created
by admin
on Fri Dec 15 20:17:52 UTC 2023
Edited
by admin
on Fri Dec 15 20:17:52 UTC 2023
Record UNII
O62AJZ9VME
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FARADIOL
Common Name English
URS-20-ENE-3,16-DIOL, (3.BETA.,16.BETA.,18.ALPHA.,19.ALPHA.)-
Common Name English
(3.BETA.,12.BETA.,18.ALPHA.,19.ALPHA.)-URS-20-ENE-3,12-DIOL
Common Name English
URS-20-ENE-3,12-DIOL, (3.BETA.,12.BETA.,18.ALPHA.,19.ALPHA.)-
Common Name English
16.BETA.-HYDROXYPSEUDOTARAXASTEROL
Common Name English
18.ALPHA.,19.BETA.H-URS-20-ENE-3.BETA.,16.BETA.-DIOL
Common Name English
Code System Code Type Description
PUBCHEM
9846222
Created by admin on Fri Dec 15 20:17:52 UTC 2023 , Edited by admin on Fri Dec 15 20:17:52 UTC 2023
PRIMARY
FDA UNII
O62AJZ9VME
Created by admin on Fri Dec 15 20:17:52 UTC 2023 , Edited by admin on Fri Dec 15 20:17:52 UTC 2023
PRIMARY
CAS
20554-95-4
Created by admin on Fri Dec 15 20:17:52 UTC 2023 , Edited by admin on Fri Dec 15 20:17:52 UTC 2023
PRIMARY
MESH
C100535
Created by admin on Fri Dec 15 20:17:52 UTC 2023 , Edited by admin on Fri Dec 15 20:17:52 UTC 2023
PRIMARY
EPA CompTox
DTXSID00942739
Created by admin on Fri Dec 15 20:17:52 UTC 2023 , Edited by admin on Fri Dec 15 20:17:52 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
CALENDULA OFFICINALIS FLOWER terpenoid