ID: 31816
SMILES:Oc1c(C2(O)C(O)COC2=O)c2c(c(O)c1)C1C=C(C)CCC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.524
CB1 binding score: -16.249
InChIKey:PAVRJZKNGOZFEF-UHFFFAOYSA-N
ID: 31817
SMILES:C12CC(C)(C(=O)C(C(C(C)=C)=C)C1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -16.325
InChIKey:AXZUTXSYMSJCDL-UHFFFAOYSA-N
ID: 31818
SMILES:C(CCCc1cc2c(c(O)c1O)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 31819
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 31820
SMILES:C1(C)(C)OC(=O)CC2(C)C(C)(C=CC(=O)Oc3ccc(CCCC)cc3O)OC3CC(OC3(C)C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.659
CB1 binding score: -13.507
InChIKey:KUDRSFRDJLVSTM-UHFFFAOYSA-N
ID: 31821
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(COCC)CCC1C(O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.722
InChIKey:UBZPOPDCNGOUIJ-UHFFFAOYSA-N
ID: 31822
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 31823
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 31824
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.47
InChIKey:MMFGVKZJRNAXJT-UHFFFAOYSA-N
ID: 31825
SMILES:C(CC=C(C)CCC=C(C)C)C1(C)Oc2c(c(O)cc(CCCCC)c2)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.234
InChIKey:HMDRIQONNZKATN-UHFFFAOYSA-N
ID: 31826
SMILES:C1C2=C(C)CC(C2)C(C)(C)Oc2c(C(C)(C=C)C)c(O)c(O)c(C)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.665
InChIKey:UYOHMYULFCKXGP-UHFFFAOYSA-N
ID: 31827
SMILES:Oc1cc(CCCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 31828
SMILES:c1cc(CC(CCC=C(CCC(C(C)CCC=C(C)C)(O)C)O)C(C)(O)C=Cc2c(O)cc(C)cc2O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.779
CB1 binding score: -15.447
InChIKey:FIIHQKNNCAEFDK-UHFFFAOYSA-N
ID: 31829
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C(O)(C2=O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.929
InChIKey:VGBVSLQJOTUVGW-UHFFFAOYSA-N
ID: 31830
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 31831
SMILES:C1(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 31832
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(C)c(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 31833
SMILES:C(CCCc1cc(OC)c(O)c2c1OC(C)(C)C1C=CC(C)CC12)Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -14.724
InChIKey:NPMPEVSITFRRRI-UHFFFAOYSA-N
ID: 31834
SMILES:OCC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 31835
SMILES:C(c1cc(OC(=O)C)c(OC(=O)C)c2c1C1C(C(C)(C)O2)CCC(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -16.675
InChIKey:JFDICCJJBDDJPV-UHFFFAOYSA-N
ID: 31836
SMILES:Oc1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.766
InChIKey:GNBSKWGIRCMMKP-UHFFFAOYSA-N