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Aflatoxin B2

CAS: 7220-81-7
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7220-81-7

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1 AFLATOXIN B2
2 Dihydroaflatoxin B1
3 Dihydroaflatoxine B1
4 CCRIS 13
5 7SKR7S646P

Aflatoxin B2 is an aflatoxin having a hexahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene skeleton with oxygen functionality at positions 1, 4 and 11.

Molecular Formula C17H14O6
Canonical SMILES
Isomeric SMILES
Molecular Weight 314.2900
InChIKey WWSYXEZEXMQWHT-WNWIJWBNSA-N
InChI InChI=1S/C17H14O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h6,8,17H,2-5H2,1H3/t8-,17+/m0/s1
XLogP 1.3000
ExactMass 314.0790
MonoisotopicMass 314.0790
TPSA 71.1000
Complexity 610.0000
Charge 0.0000
HBondDonorCount 0
HBondAcceptorCount 6
RotatableBondCount 1
HeavyAtomCount 23
IsotopeAtomCount 0
AtomStereoCount 2
DefinedAtomStereoCount 2
UndefinedAtomStereoCount 0
BondStereoCount 0
DefinedBondStereoCount 0
UndefinedBondStereoCount 0
CovalentUnitCount 1
PatentCount 1165
PatentFamilyCount 717
LiteratureCount 805