Representations & DB's id
|
| |
| ChEBI: |
CHEBI:66834
|
| ChEMBL: |
CHEMBL521803
|
| PubChem: |
10459206
|
|
IUPAC:
|
[(1S,2R,4S,5R,6R,7S,9R,12R)-4,5,12-triacetyloxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl] benzoate
|
|
Standard InChI:
|
InChI=1S/C28H36O9/c1-15-13-21(33-16(2)29)24(35-18(4)31)27(7)22(36-25(32)19-11-9-8-10-12-19)14-20-23(34-17(3)30)28(15,27)37-26(20,5)6/h8-12,15,20-24H,13-14H2,1-7H3/t15-,20-,21+,22+,23-,24+,27-,28-/m1/s1
|
|
Standard InChI Key:
|
BGJHHQRHKDDKIR-OKPVOZINSA-N
|
|
SMILES:
|
CC(=O)O[C@H]1C[C@@H](C)[C@@]23[C@]([C@H]1OC(=O)C)(C)[C@@H](OC(=O)c1ccccc1)C[C@H]([C@H]3OC(=O)C)C(O2)(C)C |
