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Details

Stereochemistry ABSOLUTE
Molecular Formula C37H58O11
Molecular Weight 678.8512
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CIMIRACEMOSIDE D

SMILES

C[C@]1([H])C[C@]2([H])[C@@]([H])(C(C)(C)O)O[C@]3([C@@]1([H])[C@@]4(C)[C@@]([H])(C[C@]56C[C@]76CC[C@@]([H])(C(C)(C)[C@]7([H])CC[C@@]5([H])[C@]4(C)[C@@]3([H])O)O[C@@]8([H])[C@@]([H])([C@]([H])([C@]([H])(CO8)O)O)O)OC(=O)C)O2

InChI

InChIKey=HZIBYJCDCHVSPK-RKUDFBBFSA-N
InChI=1S/C37H58O11/c1-17-13-20-28(32(5,6)43)48-37(47-20)27(17)34(8)24(45-18(2)38)14-36-16-35(36)12-11-23(46-29-26(41)25(40)19(39)15-44-29)31(3,4)21(35)9-10-22(36)33(34,7)30(37)42/h17,19-30,39-43H,9-16H2,1-8H3/t17-,19+,20-,21+,22+,23+,24-,25+,26-,27-,28+,29+,30-,33-,34-,35-,36+,37+/m1/s1

HIDE SMILES / InChI

Molecular Formula C37H58O11
Molecular Weight 678.8512
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 17 / 18
E/Z Centers 0
Optical Activity UNSPECIFIED

Cimiracemosides D is a triterpene glycoside isolated from rhizome of black cohosh (Cimicifuga racemosa) with unknown details.

Originator

Curator's Comment:: University of Illinois, USA

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
New triterpene diglycosides from the rhizome of Cimifuga foetida.
2008 Aug 13
Development of a fast and convenient method for the isolation of triterpene saponins from Actaea racemosa by high-speed countercurrent chromatography coupled with evaporative light scattering detection.
2010 Mar
Patents

Patents

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Curator's Comment:: Related cimiracemosides (A-H) were found to modulate GABA induced currents through GABA-A ion channel, but cimiracemoside D (compound 7) was not tested / not active in this assay.
Unknown
Substance Class Chemical
Created
by admin
on Sat Jun 26 11:26:23 UTC 2021
Edited
by admin
on Sat Jun 26 11:26:23 UTC 2021
Record UNII
38OGU4B6JD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CIMIRACEMOSIDE D
Common Name English
CIMIRACEMOSIDE D, (-)-
Common Name English
.ALPHA.-L-ARABINOPYRANOSIDE, (3.BETA.,12.BETA.,15.ALPHA.,16.ALPHA.,23R,24S)-12-(ACETYLOXY)-16,23:16,24-DIEPOXY-15,25-DIHYDROXY-9,19-CYCLOLANOSTAN-3-YL
Common Name English
Code System Code Type Description
PUBCHEM
70698290
Created by admin on Sat Jun 26 11:26:23 UTC 2021 , Edited by admin on Sat Jun 26 11:26:23 UTC 2021
PRIMARY
CAS
290821-39-5
Created by admin on Sat Jun 26 11:26:23 UTC 2021 , Edited by admin on Sat Jun 26 11:26:23 UTC 2021
PRIMARY
FDA UNII
38OGU4B6JD
Created by admin on Sat Jun 26 11:26:23 UTC 2021 , Edited by admin on Sat Jun 26 11:26:23 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT