CDK    9/10/12,15:49

 30 34  0  0  0  0  0  0  0  0999 V2000
    7.5875    0.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4500   -0.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3000    0.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5875   -0.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8792    0.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8792   -0.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1583   -0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3042    1.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4500   -1.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7375   -2.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0917    1.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1583    0.4250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8792    1.6583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5875    2.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5750    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0833    0.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0250   -1.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7375   -0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1625   -2.0500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8792   -1.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0250   -0.8167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3583    2.6875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3083   -2.0542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1625    2.0750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4417    0.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5875   -1.2250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1458   -2.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3208   -2.7625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4458   -2.4625    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1542   -1.2250    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  7  1  0  0  0  0 
  3  1  1  0  0  0  0 
  4  1  1  0  0  0  0 
  5  1  2  0  0  0  0 
  6  4  1  0  0  0  0 
  7 12  1  0  0  0  0 
  8  3  2  0  0  0  0 
  9  2  1  0  0  0  0 
 10  9  1  0  0  0  0 
 11  8  1  0  0  0  0 
 12  5  1  0  0  0  0 
 13  5  1  0  0  0  0 
 14  8  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16  3  1  0  0  0  0 
 17 21  1  0  0  0  0 
 18  2  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20  6  1  0  0  0  0 
 21 18  1  0  0  0  0 
 22 11  2  0  0  0  0 
 23 17  2  0  0  0  0 
 24 13  1  0  0  0  0 
  2 25  1  1  0  0  0 
  6 26  1  6  0  0  0 
 27 10  1  0  0  0  0 
 28 10  1  0  0  0  0 
  9 29  1  6  0  0  0 
  7 30  1  6  0  0  0 
 11 15  1  0  0  0  0 
 13 14  2  0  0  0  0 
  6  7  1  0  0  0  0 
 19  9  1  0  0  0  0 
 10 17  1  0  0  0  0 
M  END
> <ID>
CHEBI:67846

> <NAME>
Phomoarcherin B

> <DEFINITION>
A natural product found in Phomopsis archeri. 

> <STAR>
2

> <SYNONYM>
(6aR,6bS,10aR,12aS)-5-Hydroxy-6b,10,10,12a-tetramethyl-6a,7,8,10,10a,11,12,12a-octahydro-1H-benzo[a]furo[3,4-h]xanthene-3,9(6H,6bH)-dione

> <FORMULA>
C23H28O5

> <MASS>
384.46540

> <MONOISOTOPIC_MASS>
384.19367

> <CHARGE>
0

> <SMILES>
[H][C@@]12CC[C@]3(C)Oc4c(C[C@]3([H])[C@@]1(C)CCC(=O)C2(C)C)c(O)cc1C(=O)OCc41

> <INCHI>
InChI=1S/C23H28O5/c1-21(2)16-5-8-23(4)17(22(16,3)7-6-18(21)25)10-13-15(24)9-12-14(19(13)28-23)11-27-20(12)26/h9,16-17,24H,5-8,10-11H2,1-4H3/t16-,17+,22-,23-/m0/s1

> <INCHIKEY>
YHFZNBXTQFHWGR-TXKCWOHGSA-N

> <PUBMED_CITATION>
21341709

$$$$