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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H40O7
Molecular Weight 476.6023
Optical Activity UNSPECIFIED
Additional Stereochemistry Yes
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0
Stereo Comments Atropisomer of VB-106, axial

SHOW SMILES / InChI
Structure of VB-102

SMILES

CCCCCC1=CC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C([C@@H]3C=C(C)CC[C@H]3C(C)=C)C(O)=C1

InChI

InChIKey=BZANYFCNZFMERD-MGQROECQSA-N
InChI=1S/C27H40O7/c1-5-6-7-8-17-12-20(29)23(19-11-16(4)9-10-18(19)15(2)3)21(13-17)33-27-26(32)25(31)24(30)22(14-28)34-27/h11-13,18-19,22,24-32H,2,5-10,14H2,1,3-4H3/t18-,19+,22+,24+,25-,26+,27+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
VB-102
Code English
VB102
Preferred Name English
?-D-Glucopyranoside, 3-hydroxy-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentylphenyl (atropoisomer 1)
Common Name English
Code System Code Type Description
CAS
182811-12-7
Created by admin on Wed Apr 02 14:02:07 GMT 2025 , Edited by admin on Wed Apr 02 14:02:07 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
GZ6WF4Q2UM
Created by admin on Wed Apr 02 14:02:07 GMT 2025 , Edited by admin on Wed Apr 02 14:02:07 GMT 2025
PRIMARY
PUBCHEM
140910891
Created by admin on Wed Apr 02 14:02:07 GMT 2025 , Edited by admin on Wed Apr 02 14:02:07 GMT 2025
PRIMARY