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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H50O3
Molecular Weight 458.7173
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PRIMULAGENIN A

SMILES

CC1(C)CC[C@@]2(CO)[C@@]([H])(C1)C3=CC[C@]4([H])[C@@]5(C)CC[C@@]([H])(C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)C[C@@]2([H])O)O

InChI

InChIKey=YHGVYECWZWIVJC-TVZJSHMMSA-N
InChI=1S/C30H50O3/c1-25(2)14-15-30(18-31)20(16-25)19-8-9-22-27(5)12-11-23(32)26(3,4)21(27)10-13-28(22,6)29(19,7)17-24(30)33/h8,20-24,31-33H,9-18H2,1-7H3/t20-,21-,22+,23-,24+,27-,28+,29+,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H50O3
Molecular Weight 458.7173
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Jun 25 23:32:29 UTC 2021
Edited
by admin
on Fri Jun 25 23:32:29 UTC 2021
Record UNII
55Z6ND22N6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PRIMULAGENIN A
Common Name English
GENIN A (PRIMULA)
Common Name English
OLEAN-12-ENE-3,16,28-TRIOL, (3.BETA.,16.ALPHA.)-
Systematic Name English
SCHIWALLIGENIN B1
Common Name English
OLEAN-12-ENE-3.BETA.,16.ALPHA.,28-TRIOL
Common Name English
GENIN A
Common Name English
Code System Code Type Description
PUBCHEM
10004345
Created by admin on Fri Jun 25 23:32:29 UTC 2021 , Edited by admin on Fri Jun 25 23:32:29 UTC 2021
PRIMARY
CAS
465-95-2
Created by admin on Fri Jun 25 23:32:29 UTC 2021 , Edited by admin on Fri Jun 25 23:32:29 UTC 2021
PRIMARY
FDA UNII
55Z6ND22N6
Created by admin on Fri Jun 25 23:32:29 UTC 2021 , Edited by admin on Fri Jun 25 23:32:29 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT