Sigmoidin B

(2S)-2-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one

CAS: 87746-47-2

Molecular Formula	`C20H20O6`
Molecular Weight	356.4 g/mol
LogP	4.0
Topological Polar Surface Area	107.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	6
Rotatable Bonds	3
Exact Mass	356.12598
Heavy Atoms	26
Complexity	542.0

Chemical Identifiers

CAS Number	87746-47-2
SMILES	`CC(=CCC1=C(C(=CC(=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O)O)C`
InChIKey	`SFQIGPZCFNTPOD-KRWDZBQOSA-N`

📖 Product Overview

Sigmoidin B (CAS: 87746-47-2) is a chemical compound with molecular formula C20H20O6 and molecular weight 356.4 g/mol. Its IUPAC systematic name is (2S)-2-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-2,3-dihydrochromen-4-one. LogP 4.0 Topological Polar Surface Area 107.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 6 Rotatable Bonds 3 Exact Mass 356.12598 Heavy Atoms 26 Complexity 542.0 InChI Key: SFQIGPZCFNTPOD-KRWDZBQOSA-N. SMILES: CC(=CCC1=C(C(=CC(=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O)O)C.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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