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Details

Stereochemistry ABSOLUTE
Molecular Formula C45H44O11
Molecular Weight 760.8243
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Kuwanon H

SMILES

CC(C)=CCC1=C(O)C=CC(C(=O)[C@H]2[C@@H](CC(C)=C[C@@H]2C3=C4OC(=C(CC=C(C)C)C(=O)C4=C(O)C=C3O)C5=C(O)C=C(O)C=C5)C6=C(O)C=C(O)C=C6)=C1O

InChI

InChIKey=DKBPTKFKCCNXNH-QXGWMLRCSA-N
InChI=1S/C45H44O11/c1-21(2)6-10-27-33(48)15-14-29(41(27)53)42(54)38-31(26-12-8-24(46)18-34(26)49)16-23(5)17-32(38)39-36(51)20-37(52)40-43(55)30(11-7-22(3)4)44(56-45(39)40)28-13-9-25(47)19-35(28)50/h6-9,12-15,17-20,31-32,38,46-53H,10-11,16H2,1-5H3/t31-,32-,38-/m0/s1

HIDE SMILES / InChI

Molecular Formula C45H44O11
Molecular Weight 760.8243
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:19:06 GMT 2023
Edited
by admin
on Sat Dec 16 15:19:06 GMT 2023
Record UNII
822Q5M4B5D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Kuwanon H
Common Name English
8-[(1S,5R,6S)-6-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one
Systematic Name English
Albanin G
Common Name English
4H-1-Benzopyran-4-one, 8-[(1S,5R,6S)-6-[2,4-dihydroxy-3-(3-methyl-2-buten-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-buten-1-yl)-
Systematic Name English
Moracenin A
Common Name English
NSC-356889
Code English
2-(2,4-BIS(OXIDANYL)PHENYL)-8-((1S,5S,6R)-5-(2,4-BIS(OXIDANYL)PHENYL)-3-METHYL-6-(3-(3-METHYLBUT-2-ENYL)-2,4-BIS(OXIDANYL)PHENYL)CARBONYL-CYCLOHEX-2-EN-1-YL)-3-(3-METHYLBUT-2-ENYL)-5,7-BIS(OXIDANYL)CHROMEN-4-ONE
Systematic Name English
4H-1-Benzopyran-4-one, 8-[6-[2,4-dihydroxy-3-(3-methyl-2-butenyl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methyl-2-butenyl)-, [1S-(1α,5α,6β)]-
Systematic Name English
8-((1R,2S,3S)-2-(2,4-Dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl)-2',4'-dihydroxy-5-methyl-1,2,3,6-tetrahydro-[1,1'-biphenyl]-3-yl)-2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(3-methylbut-2-en-1-yl)-4H-chromen-4-one
Systematic Name English
Code System Code Type Description
NSC
356889
Created by admin on Sat Dec 16 15:19:06 GMT 2023 , Edited by admin on Sat Dec 16 15:19:06 GMT 2023
PRIMARY
PUBCHEM
5281668
Created by admin on Sat Dec 16 15:19:06 GMT 2023 , Edited by admin on Sat Dec 16 15:19:06 GMT 2023
PRIMARY
FDA UNII
822Q5M4B5D
Created by admin on Sat Dec 16 15:19:06 GMT 2023 , Edited by admin on Sat Dec 16 15:19:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID301318627
Created by admin on Sat Dec 16 15:19:06 GMT 2023 , Edited by admin on Sat Dec 16 15:19:06 GMT 2023
PRIMARY
CAS
76472-87-2
Created by admin on Sat Dec 16 15:19:06 GMT 2023 , Edited by admin on Sat Dec 16 15:19:06 GMT 2023
PRIMARY
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