ID: 43954
SMILES:C1CC2(C(C)C)Oc3c(c(O)cc(CCCCC)c3)C2C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -13.824
InChIKey:XJESIUAFQFVIRY-UHFFFAOYSA-N
ID: 43955
SMILES:CC(C1=CCC(C)CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.45
InChIKey:MNJRXMSOZKGACN-UHFFFAOYSA-N
ID: 43956
SMILES:c12c(O)cc(CCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 43957
SMILES:C(c1c(O)cc(C)c2c1OC1(C)C=CCC(C)(C=C)C1C2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.76
InChIKey:RVOBZXSZWNVNNH-UHFFFAOYSA-N
ID: 43958
SMILES:C12c3c(c(CCCCC)ccc3)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.105
InChIKey:HBIPQOCRSZLVER-UHFFFAOYSA-N
ID: 43959
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1=C(C(C)(CCC=C(C)C)C(O)C2)CC(O)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -17.896
InChIKey:VAQRMPOOFQWPAO-UHFFFAOYSA-N
ID: 43960
SMILES:C1C(O)C(C)=C2c3c(cc(C)cc3O)OC(C)(C)C2CCC(CO)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -12.001
InChIKey:RDRFNAAWKUQXDG-UHFFFAOYSA-N
ID: 43961
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: 43962
SMILES:C(C=C(C)C)C1c2c(O)c(C=O)c(CCCCC)cc2OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.199
InChIKey:LUKXCQUNWGUSAQ-UHFFFAOYSA-N
ID: 43963
SMILES:C12(c3c(cc(CCCCC)cc3O)OC(C)(C)C1)CC(O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.607
InChIKey:CRLKFCBCFLIQBW-UHFFFAOYSA-N
ID: 43964
SMILES:O(c1c(Cl)c2c(c3c1OC(C)(C)C1CCC(C)=CC13)cccc2C)CCCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 469.109
CB1 binding score: -17.444
InChIKey:VOYXQOOOOBGYBZ-UHFFFAOYSA-N
ID: 43965
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCC)c3O2)C2CC(C)=CC(=O)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.43
InChIKey:LQPGGOYYPHYFAJ-UHFFFAOYSA-N
ID: 43966
SMILES:C12C(c3ccccc3)c3c(cc(CCCCC)cc3O)OC(C)(C=C1)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.469
CB1 binding score: -16.228
InChIKey:MNIBBAPBDLFDNL-UHFFFAOYSA-N
ID: 43967
SMILES:Oc1c(CCCC)cc(O)c(CC=C(C)CC(C=C(C)C)O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.315
InChIKey:SRHCMNSPVHBNND-UHFFFAOYSA-N
ID: 43968
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.374
InChIKey:GIXGVVPJMNOWPU-UHFFFAOYSA-N
ID: 43969
SMILES:CC1=CC2C(C(C)C)(Oc3c(c(O)cc(CCC)c3)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.214
InChIKey:WLBNHQXIMGKPEM-UHFFFAOYSA-N
ID: 43970
SMILES:C1(C)(C)c2c(cc(C)c(O)c2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 43971
SMILES:C12cCC(C(O)C1=C(c1ccccc1)c1c(O)cc(CCCCC)cc1O)C(C)(C)C2CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.712
CB1 binding score: -14.73
InChIKey:XWZUSTMPLLAMMO-UHFFFAOYSA-N
ID: 43972
SMILES:O=C1Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(C)C)CCC2(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.638
InChIKey:ZQLUQYMDYDDQPD-UHFFFAOYSA-N
ID: 43973
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1=C2C2=C(C)C(O)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.507
InChIKey:IQXDHDCLEXOUMN-UHFFFAOYSA-N
ID: 43974
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(CCC(O)C)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.118
InChIKey:UTPNHBUULGRLMO-UHFFFAOYSA-N