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Details

Stereochemistry ABSOLUTE
Molecular Formula C43H64O11
Molecular Weight 756.9617
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of GAMBIEROL

SMILES

C[C@]12C[C@@]3(C)O[C@H]4C[C@H]5O[C@H]6C[C@H]7O[C@@H](CCCO)C[C@H](O)[C@]7(C)O[C@]6(C)C[C@@H]5O[C@@H]4CC[C@@H]3O[C@@H]1C[C@@H]8O[C@H](\C=C/C=C\CC=C)[C@@](C)(O)C=C[C@H]8O2

InChI

InChIKey=GKLILONDTZZKRF-IDJCTBPMSA-N
InChI=1S/C43H64O11/c1-7-8-9-10-11-14-34-39(2,46)18-17-28-30(49-34)22-36-42(5,52-28)25-41(4)35(51-36)16-15-27-31(53-41)21-29-32(48-27)24-40(3)37(50-29)23-38-43(6,54-40)33(45)20-26(47-38)13-12-19-44/h7,9-11,14,17-18,26-38,44-46H,1,8,12-13,15-16,19-25H2,2-6H3/b10-9-,14-11-/t26-,27+,28+,29+,30-,31-,32-,33-,34+,35-,36+,37-,38+,39-,40+,41+,42-,43-/m0/s1

HIDE SMILES / InChI

Molecular Formula C43H64O11
Molecular Weight 756.9617
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 18 / 18
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
844Q8WC5F6
Record Status Validated (UNII)
Record Version