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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H46O13
Molecular Weight 578.6463
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CGP-69669A FREE ACID

SMILES

[H][C@]1(CCCC[C@H]1O[C@]2([H])O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H](CC4CCCCC4)C(O)=O)[C@H]3O

InChI

InChIKey=GNTJIZLFEURZBX-NNIOFZNDSA-N
InChI=1S/C27H46O13/c1-13-19(29)21(31)22(32)26(36-13)38-15-9-5-6-10-16(15)39-27-23(33)24(20(30)18(12-28)40-27)37-17(25(34)35)11-14-7-3-2-4-8-14/h13-24,26-33H,2-12H2,1H3,(H,34,35)/t13-,15+,16+,17-,18+,19+,20-,21+,22-,23+,24-,26-,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H46O13
Molecular Weight 578.6463
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 13 / 13
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:24:13 GMT 2023
Edited
by admin
on Sat Dec 16 09:24:13 GMT 2023
Record UNII
BL5J66RL5D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CGP-69669A FREE ACID
Common Name English
.BETA.-D-GALACTOPYRANOSIDE, (1R,2R)-2-((6-DEOXY-.ALPHA.-L-GALACTOPYRANOSYL)OXY)CYCLOHEXYL 3-O-((1S)-1-CARBOXY-2-CYCLOHEXYLETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
BL5J66RL5D
Created by admin on Sat Dec 16 09:24:13 GMT 2023 , Edited by admin on Sat Dec 16 09:24:13 GMT 2023
PRIMARY
PUBCHEM
10817023
Created by admin on Sat Dec 16 09:24:13 GMT 2023 , Edited by admin on Sat Dec 16 09:24:13 GMT 2023
PRIMARY
CAS
293752-60-0
Created by admin on Sat Dec 16 09:24:13 GMT 2023 , Edited by admin on Sat Dec 16 09:24:13 GMT 2023
PRIMARY
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ACTIVE MOIETY