ID: 69616
SMILES:CCCCCc1cc(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: 69617
SMILES:C12C(C(C)CCC1)C(CC(=CCc1c(O)cc(C)cc1O)C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.555
InChIKey:UBJWOZIOYGXKSN-UHFFFAOYSA-N
ID: 69618
SMILES:O1C(CO)C(O)C(O)C(O)C1OCC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -16.775
InChIKey:XLAKLUKOUJQOFH-UHFFFAOYSA-N
ID: 69619
SMILES:O=C(c1ccc2c(c1CCCCC)OC(C)(C)C1CCC(C)=CC12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.584
InChIKey:SZZJSAFNJNPHLS-UHFFFAOYSA-N
ID: 69620
SMILES:C1(C(C)=C)CCC(C)=CC1c1c(OC)ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -18.084
InChIKey:GYWDFTHNGINNKN-UHFFFAOYSA-N
ID: 69621
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(O)(C)CCC=C(C)C)(C(O)C(C)=C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.491
InChIKey:HRJGOTLASIYQSD-UHFFFAOYSA-N
ID: 69622
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C=O)=C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.051
InChIKey:ITJFDCQQERLJGT-UHFFFAOYSA-N
ID: 69623
SMILES:c12c(cc(O)cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.541
InChIKey:DXDRGIVLXHOGHC-UHFFFAOYSA-N
ID: 69624
SMILES:O1c2cc(CCCC)c(OC)c(O)c2C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.422
InChIKey:PTQHQDPMLDIFDB-UHFFFAOYSA-N
ID: 69625
SMILES:CC1=CC2c3c(O)cc(C)cc3OCC(C)CC(=O)C1CC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -18.484
InChIKey:CWQFLRKVMNXOHO-UHFFFAOYSA-N
ID: 69626
SMILES:c1c2c(ccc1)C1C(C(C)(C)O2)CCC(C)(O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.434
InChIKey:KBQBLRDSYHIQGT-UHFFFAOYSA-N
ID: 69627
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(=C(CC(=O)C=C(C)C)C)OC1CC(O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.807
InChIKey:MTINSMJLVKZHPW-UHFFFAOYSA-N
ID: 69628
SMILES:C1(C)(C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.27
InChIKey:JNUWKSNIBRJTBP-UHFFFAOYSA-N
ID: 69629
SMILES:C1(C)(O)CCC(C(C)=C)C(c2c(O)cc(CCCCC)c(O)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.769
InChIKey:UMWPNMWXXOWCJL-UHFFFAOYSA-N
ID: 69630
SMILES:CC(C)CC(c1c(O)cc(O)c2c1OC1(C)C(C=CC(C)(C)C1)C2)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.641
InChIKey:VRNFNHJLUJOQEC-UHFFFAOYSA-N
ID: 69631
SMILES:c1(O)c(CC(O)C(C)C)c2c(c(O)c1CC=C(CCC=C(C)C)C)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -14.359
InChIKey:IXOXIHQFRVPROV-UHFFFAOYSA-N
ID: 69632
SMILES:c1(CCCO)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -14.845
InChIKey:YPMICKFPVWLZNY-UHFFFAOYSA-N
ID: 69633
SMILES:C12C(C)(C)C(Br)CCC1(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.381
CB1 binding score: -17.636
InChIKey:XEXBDTKYMSGJTR-UHFFFAOYSA-N
ID: 69634
SMILES:CC1CC(C)(C)OC2(C)CCC(C)=CCCC(C)(C)OC(c3ccc(N)cc3)=C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 397.603
CB1 binding score: -7.332
InChIKey:QHRCQIHDJAKFTF-UHFFFAOYSA-N
ID: 69635
SMILES:C1(C)(C)C2C(C)(CCC1)Oc1c(cc(CCCCC)cc1O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.298
InChIKey:BXDONIIVZXTLCN-UHFFFAOYSA-N
ID: 69636
SMILES:O(c1cc(CCCCC)cc(O)c1C1CC(C)=CCC1C(=C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.696
InChIKey:HYNYRWBHLSVRRM-UHFFFAOYSA-N