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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H26O12
Molecular Weight 578.5202
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Procyanidin B6

SMILES

[H][C@@]1(OC2=CC(O)=C(C(O)=C2C[C@@H]1O)[C@@]3([H])[C@H](O)[C@]([H])(OC4=CC(O)=CC(O)=C34)C5=CC(O)=C(O)C=C5)C6=CC(O)=C(O)C=C6

InChI

InChIKey=GMISZFQPFDAPGI-ZBRHZRBFSA-N
InChI=1S/C30H26O12/c31-13-7-19(36)24-23(8-13)42-30(12-2-4-16(33)18(35)6-12)28(40)26(24)25-20(37)10-22-14(27(25)39)9-21(38)29(41-22)11-1-3-15(32)17(34)5-11/h1-8,10,21,26,28-40H,9H2/t21-,26-,28-,29+,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H26O12
Molecular Weight 578.5202
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
SZ77QV8UB3
Record Status Validated (UNII)
Record Version