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Details

Stereochemistry ABSOLUTE
Molecular Formula C36H62O9
Molecular Weight 638.8721
Optical Activity UNSPECIFIED
Defined Stereocenters 16 / 16
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 20,24-EPOXY-12,25-DIHYDROXYDAMMARAN-3-YL-BETA-D-GLUCOPYRANOSIDE, (3BETA,12BETA,24S)-

SMILES

[H][C@@]1(CC[C@]2(C)[C@]1([H])[C@H](O)C[C@]3([H])[C@@]4(C)CC[C@H](O[C@]5([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(C)(C)[C@]4([H])CC[C@@]23C)[C@]6(C)CC[C@H](O6)C(C)(C)O

InChI

InChIKey=ZIRHYQFOBJNNCZ-JDOJIHOHSA-N
InChI=1S/C36H62O9/c1-31(2)22-10-15-34(6)23(33(22,5)13-11-24(31)44-30-29(41)28(40)27(39)21(18-37)43-30)17-20(38)26-19(9-14-35(26,34)7)36(8)16-12-25(45-36)32(3,4)42/h19-30,37-42H,9-18H2,1-8H3/t19-,20+,21+,22-,23+,24-,25-,26-,27+,28-,29+,30-,33-,34+,35+,36-/m0/s1

HIDE SMILES / InChI

Molecular Formula C36H62O9
Molecular Weight 638.8721
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 16 / 16
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:16:18 GMT 2023
Edited
by admin
on Sat Dec 16 16:16:18 GMT 2023
Record UNII
G2FX6NK0X4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
20,24-EPOXY-12,25-DIHYDROXYDAMMARAN-3-YL-BETA-D-GLUCOPYRANOSIDE, (3BETA,12BETA,24S)-
Common Name English
(20S,24S)-EPOXYDAMMARANE-12,25-DIOL-3-BETA-D-GLUCOPYRANOSIDE
Systematic Name English
20(S)-GINSENOSIDE RH2 METABOLITE M1-3
Common Name English
.BETA.-D-GLUCOPYRANOSIDE, (3.BETA.,12.BETA.,24S)-20,24-EPOXY-12,25-DIHYDROXYDAMMARAN-3-YL
Systematic Name English
(3.BETA.,12.BETA.,24S)-20,24-EPOXY-12,25-DIHYDROXYDAMMARAN-3-YL .BETA.-D-GLUCOPYRANOSIDE
Systematic Name English
Code System Code Type Description
CAS
1698873-53-8
Created by admin on Sat Dec 16 16:16:18 GMT 2023 , Edited by admin on Sat Dec 16 16:16:18 GMT 2023
PRIMARY
FDA UNII
G2FX6NK0X4
Created by admin on Sat Dec 16 16:16:18 GMT 2023 , Edited by admin on Sat Dec 16 16:16:18 GMT 2023
PRIMARY
PUBCHEM
118753430
Created by admin on Sat Dec 16 16:16:18 GMT 2023 , Edited by admin on Sat Dec 16 16:16:18 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
IN VITRO