Procyanidin B2 3,3′-di-O-gallate
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Procyanidin B2 3,3′-di-O-gallate
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CAS No:
79907-44-1
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Formula:
C44H34O20
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Chemical Name:
Procyanidin B2 3,3′-di-O-gallate
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Synonyms:
Benzoic acid,3,4,5-trihydroxy-,(2R,2′R,3R,3′R,4R)-2,2′-bis(3,4-dihydroxyphenyl)-3,3′,4,4′-tetrahydro-5,5′,7,7′-tetrahydroxy[4,8′-bi-2H-1-benzopyran]-3,3′-diyl ester;Benzoic acid,3,4,5-trihydroxy-,2,2′-bis(3,4-dihydroxyphenyl)-3,3′,4,4′-tetrahydro-5,5′,7,7′-tetrahydroxy[4,8′-bi-2H-1-benzopyran]-3,3′-diyl ester,[2R-[2α,3α,4β(2′R*,3′R*)]]-;Procyanidin B2 3,3′-di-O-gallate;Proanthocyanidin B2 3,3′-O-gallate;(2R,3R)-3-O-Galloylepicatechin-4β,8-[(2R,3R)-3-O-galloylepicatechin];(-)-Epicatechin-3-O-galloyl-(4β,8)-(-)-epicatechin-3-O-gallate;3,3′-Digalloylprocyanidin B2;[3-O-Galloyl]-(-)-epicatechin-(4β,8)-(+)-epicatechin-3-O-gallate;168831-82-1;197705-92-3
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CAS No:
Computed Properties
Molecular Weight:882.7
XLogP3:4.7
Hydrogen Bond Donor Count:14
Hydrogen Bond Acceptor Count:20
Rotatable Bond Count:9
Exact Mass:882.16434347
Monoisotopic Mass:882.16434347
Topological Polar Surface Area:354
Heavy Atom Count:64
Complexity:1580
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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