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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H38O8
Molecular Weight 502.5965
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CKD-731

SMILES

[H][C@@]1([C@H](OC)[C@@H](CC[C@]12CO2)OC(=O)\C=C\C3=CC(OC)=C(OC)C(OC)=C3)[C@@]4(C)O[C@@H]4CC=C(C)C

InChI

InChIKey=YALIVVKJRYVKNB-GGHPKCFRSA-N
InChI=1S/C28H38O8/c1-17(2)8-10-22-27(3,36-22)26-25(33-7)19(12-13-28(26)16-34-28)35-23(29)11-9-18-14-20(30-4)24(32-6)21(15-18)31-5/h8-9,11,14-15,19,22,25-26H,10,12-13,16H2,1-7H3/b11-9+/t19-,22-,25-,26-,27+,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula C28H38O8
Molecular Weight 502.5965
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:38:16 GMT 2023
Edited
by admin
on Sat Dec 16 08:38:16 GMT 2023
Record UNII
540N75454L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CKD-731
Common Name English
2-PROPENOIC ACID, 3-(3,4,5-TRIMETHOXYPHENYL)-, (3R,4S,5S,6R)-5-METHOXY-4-((2R,3R)-2-METHYL-3-(3-METHYL-2-BUTENYL)OXIRANYL)-1-OXASPIRO(2.5)OCT-6-YL ESTER, (2E)-
Systematic Name English
O-(3,4,5-TRIMETHOXY-TRANS-CINNAMOYL)FUMAGILLOL
Systematic Name English
Code System Code Type Description
CAS
251111-15-6
Created by admin on Sat Dec 16 08:38:16 GMT 2023 , Edited by admin on Sat Dec 16 08:38:16 GMT 2023
PRIMARY
PUBCHEM
9935823
Created by admin on Sat Dec 16 08:38:16 GMT 2023 , Edited by admin on Sat Dec 16 08:38:16 GMT 2023
PRIMARY
FDA UNII
540N75454L
Created by admin on Sat Dec 16 08:38:16 GMT 2023 , Edited by admin on Sat Dec 16 08:38:16 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY