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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H26O7
Molecular Weight 366.4055
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-HYDROXYCALONECTRIN

SMILES

CC(=O)OC[C@]12[C@H](O)CC(C)=C[C@H]1O[C@@H]3[C@@H](C[C@@]2(C)[C@]34CO4)OC(C)=O

InChI

InChIKey=BIVJZMRENLVZDT-NVTXSZTESA-N
InChI=1S/C19H26O7/c1-10-5-14(22)18(8-23-11(2)20)15(6-10)26-16-13(25-12(3)21)7-17(18,4)19(16)9-24-19/h6,13-16,22H,5,7-9H2,1-4H3/t13-,14-,15-,16-,17-,18+,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H26O7
Molecular Weight 366.4055
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
7PT252WDV2
Record Status Validated (UNII)
Record Version