ID: 62623
SMILES:CCc1ccc2c(c1)OC(C)(C)C1CCC(=C)C(O)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.605
InChIKey:WEZNYZXNZYVLBF-UHFFFAOYSA-N
ID: 62624
SMILES:C1(C)=CCC2C(C)(C)Oc3ccc(O)cc3C2CC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.17
InChIKey:XOBFWGGXRFRKJN-UHFFFAOYSA-N
ID: 62625
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 62626
SMILES:COC(C1(O)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CCC1C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.415
InChIKey:QRZAMFOZKKJJKW-UHFFFAOYSA-N
ID: 62627
SMILES:C(CCC1(C)C(C)CC2c3c(O)cc(C)cc3OC12C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15
InChIKey:BOEDQJUBIGBWBY-UHFFFAOYSA-N
ID: 62628
SMILES:C12C(C)(CCC(C(C)C)C1OC(=O)C(C)=CC)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -13.316
InChIKey:QBDPZQJPWZODIV-UHFFFAOYSA-N
ID: 62629
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 62630
SMILES:C(C(C)=C1CC(c2c(OC)ccc(CCCCC)c2)C=C(C)CC1)CCC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.659
CB1 binding score: -14.044
InChIKey:NGYIOPKLKOITSK-UHFFFAOYSA-N
ID: 62631
SMILES:Oc1c(C=C(C=O)C)c(CCCCC)ccc1C1CC(C)(C)OCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.377
InChIKey:OUCJJUKTDZABSB-UHFFFAOYSA-N
ID: 62632
SMILES:c1(C2C(C(C)=C)C(c3cc(CC[N+](C)(O)C)ccc3OC)C=C(C)CC2)ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.617
CB1 binding score: -14.886
InChIKey:FRRWDAPIVYTXDC-UHFFFAOYSA-N
ID: 62633
SMILES:c1c(O)ccc2c1-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -17.529
InChIKey:WQXFMLNUWABCFK-UHFFFAOYSA-N
ID: 62634
SMILES:C1(C(C)=C)C(Oc2c(Br)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 393.365
CB1 binding score: -14.681
InChIKey:LXLQHPLNMKJVCV-UHFFFAOYSA-N
ID: 62635
SMILES:C1(C)(C)Cc2c(cc(CCCCC)cc2OC)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.023
InChIKey:HRFIYIMOSPHATP-UHFFFAOYSA-N
ID: 62636
SMILES:C1(C(C)=C)C(C)(CCC(OC(=O)C)C(=CCC2C(C)=CCC(Br)C2(C)C)C)Oc2c1c(O)cc(C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 559.585
CB1 binding score: -14.315
InChIKey:OMYFWNZADWTQBE-UHFFFAOYSA-N
ID: 62637
SMILES:C(C(Oc1cc2c(c3c1cccc3C)OC(C)(C)C1CC=C(C)CC21)=O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -16.62
InChIKey:ZKWHKKKWUXMNOT-UHFFFAOYSA-N
ID: 62638
SMILES:c12c(c(O)cc(C)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 62639
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 62640
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1OC(C)(C)C(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.824
InChIKey:VJVISCMVBXGKEH-UHFFFAOYSA-N
ID: 62641
SMILES:c1(CCCCC)cc(O)c2c(c1)C1C(CC2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.53
InChIKey:AAAVPWLYVVAPMR-UHFFFAOYSA-N
ID: 62642
SMILES:O(c1c2c(cc(CCCCC)c1)C1CC(C(O)O)=CCC1C(C)(C)O2)C1C(O)C(O)C(O)CO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.582
CB1 binding score: -12.857
InChIKey:BUXSGJRADJJUDD-UHFFFAOYSA-N
ID: 62643
SMILES:c12c(cc(CCCCC)c(O)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.497
InChIKey:MPSLHJUTUUBRHL-UHFFFAOYSA-N