Representations & DB's id
|
| |
| ChEBI: |
None
|
| ChEMBL: |
CHEMBL472848
|
| PubChem: |
10414921
|
|
IUPAC:
|
[(1R,2S,3S,4aS,6R,8R,8aS)-8-[(1E)-2-acetylbuta-1,3-dienyl]-2,6-diacetyloxy-3-hydroxy-4,4,8a-trimethyl-7-oxo-2,3,4a,5,6,8-hexahydro-1H-naphthalen-1-yl] benzoate
|
|
Standard InChI:
|
InChI=1S/C30H36O9/c1-8-19(16(2)31)14-21-24(34)22(37-17(3)32)15-23-29(5,6)26(35)25(38-18(4)33)27(30(21,23)7)39-28(36)20-12-10-9-11-13-20/h8-14,21-23,25-27,35H,1,15H2,2-7H3/b19-14+/t21-,22+,23-,25-,26+,27-,30+/m0/s1
|
|
Standard InChI Key:
|
PHXNLVUWPCOMGG-HSGILHHISA-N
|
|
SMILES:
|
C=C/C(=C[C@H]1C(=O)[C@H](OC(=O)C)C[C@@H]2[C@]1(C)[C@@H](OC(=O)c1ccccc1)[C@@H](OC(=O)C)[C@H](C2(C)C)O)/C(=O)C |
