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Details

Stereochemistry EPIMERIC
Molecular Formula C36H62O10
Molecular Weight 654.8715
Optical Activity UNSPECIFIED
Defined Stereocenters 16 / 17
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 20,24-EPOXY-12,25,26-TRIHYDROXYDAMMARAN-3-YL-BETA-D-GLUCOPYRANOSIDE, (3BETA,12BETA,24R)-

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)(O)CO

InChI

InChIKey=KFHAXWKYIZJFQE-SXYAWALCSA-N
InChI=1S/C36H62O10/c1-31(2)22-9-14-33(4)23(32(22,3)12-10-24(31)45-30-29(42)28(41)27(40)21(17-37)44-30)16-20(39)26-19(8-13-34(26,33)5)36(7)15-11-25(46-36)35(6,43)18-38/h19-30,37-43H,8-18H2,1-7H3/t19-,20+,21+,22-,23+,24-,25+,26-,27+,28-,29+,30-,32-,33+,34+,35?,36-/m0/s1

HIDE SMILES / InChI

Molecular Formula C36H62O10
Molecular Weight 654.8715
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 16 / 17
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:55:33 GMT 2023
Edited
by admin
on Sat Dec 16 15:55:33 GMT 2023
Record UNII
7EQB4DV2GG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
20,24-EPOXY-12,25,26-TRIHYDROXYDAMMARAN-3-YL-BETA-D-GLUCOPYRANOSIDE, (3BETA,12BETA,24R)-
Common Name English
20(S)-GINSENOSIDE RH2 METABOLITE M3-11
Common Name English
EPOXYDAMMARANE-12,25,26-TRIOL-3-BETA-D-GLUCOPYRANOSIDE, (20S,24R)-
Common Name English
.BETA.-D-GLUCOPYRANOSIDE, (3.BETA.,12.BETA.,24R)-20,24-EPOXY-12,25,26-TRIHYDROXYDAMMARAN-3-YL
Systematic Name English
Code System Code Type Description
CAS
1703784-11-5
Created by admin on Sat Dec 16 15:55:33 GMT 2023 , Edited by admin on Sat Dec 16 15:55:33 GMT 2023
PRIMARY
FDA UNII
7EQB4DV2GG
Created by admin on Sat Dec 16 15:55:33 GMT 2023 , Edited by admin on Sat Dec 16 15:55:33 GMT 2023
PRIMARY
PUBCHEM
118753437
Created by admin on Sat Dec 16 15:55:33 GMT 2023 , Edited by admin on Sat Dec 16 15:55:33 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
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