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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H36O13
Molecular Weight 628.6204
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUFFRUPAEONIDANIN F

SMILES

[H][C@@]12C[C@@]5(O[C@@H]3O[C@H](COC(=O)C4=CC=C(OC)C=C4)[C@@H](O)[C@H](O)[C@H]3O)[C@]1(COC(=O)C6=CC=CC=C6)[C@@H](OC)O[C@@]5(C)CC2=O

InChI

InChIKey=WTLQAQILZQZIGE-SMSYYATHSA-N
InChI=1S/C32H36O13/c1-30-14-21(33)20-13-32(30,31(20,29(40-3)45-30)16-42-27(38)17-7-5-4-6-8-17)44-28-25(36)24(35)23(34)22(43-28)15-41-26(37)18-9-11-19(39-2)12-10-18/h4-12,20,22-25,28-29,34-36H,13-16H2,1-3H3/t20-,22+,23+,24-,25+,28-,29-,30-,31-,32-/m0/s1

HIDE SMILES / InChI

Molecular Formula C32H36O13
Molecular Weight 628.6204
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:18:03 GMT 2023
Edited
by admin
on Sat Dec 16 08:18:03 GMT 2023
Record UNII
M2XVR929WN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SUFFRUPAEONIDANIN F
Common Name English
7-OXATRICYCLO(4.3.0.0^3,9)NONAN-4-ONE, 9-((BENZOYLOXY)METHYL)-8-METHOXY-1-((6-O-(4-METHOXYBENZOYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-6-METHYL-, (1R,3R,6S,8S,9S)-
Systematic Name English
(1R,3R,6S,8S,9S)-9-((BENZOYLOXY)METHYL)-8-METHOXY-1-((6-O-(4-METHOXYBENZOYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-6-METHYL-7-OXATRICYCLO(4.3.0.03,9)NONAN-4-ONE
Systematic Name English
Code System Code Type Description
CAS
1528763-69-0
Created by admin on Sat Dec 16 08:18:03 GMT 2023 , Edited by admin on Sat Dec 16 08:18:03 GMT 2023
PRIMARY
PUBCHEM
162368345
Created by admin on Sat Dec 16 08:18:03 GMT 2023 , Edited by admin on Sat Dec 16 08:18:03 GMT 2023
PRIMARY
FDA UNII
M2XVR929WN
Created by admin on Sat Dec 16 08:18:03 GMT 2023 , Edited by admin on Sat Dec 16 08:18:03 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
Compound was tested for anticomplement activity through the Classical Pathway (CP) and Alternative Pathway (AP).