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119269-73-7

119269-73-7 | 6H-Benzofuro[3,2-c]furo[3,2-g][1]benzopyran-9-ol, 6a,11a-dihydro-10-(3-methyl-2-butenyl)- (9CI)

CAS No: 119269-73-7 Catalog No: AG000IGZ MDL No:

Product Description

Catalog Number:
AG000IGZ
Chemical Name:
6H-Benzofuro[3,2-c]furo[3,2-g][1]benzopyran-9-ol, 6a,11a-dihydro-10-(3-methyl-2-butenyl)- (9CI)
CAS Number:
119269-73-7
Molecular Formula:
C22H20O4
Molecular Weight:
348.3918
IUPAC Name:
18-(3-methylbut-2-enyl)-7,11,20-trioxapentacyclo[11.7.0.02,10.04,8.014,19]icosa-2(10),3,5,8,14(19),15,17-heptaen-17-ol
InChI:
InChI=1S/C22H20O4/c1-12(2)3-4-15-18(23)6-5-14-17-11-25-20-10-19-13(7-8-24-19)9-16(20)22(17)26-21(14)15/h3,5-10,17,22-23H,4,11H2,1-2H3
InChI Key:
VAVHXRDWDOYXSV-UHFFFAOYSA-N
SMILES:
CC(=CCc1c(O)ccc2c1OC1C2COc2c1cc1ccoc1c2)C

Properties

Complexity:
556  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.136g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
348.398g/mol
Monoisotopic Mass:
348.136g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
5  

Literature

Title Journal
Prenylated isoflavanone from Erythrina eriotricha. Phytochemistry 19951201

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