ID: 27595
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 27596
SMILES:CC(C(c1c(C)cc2c(c1O)C1C(CC(C)=C)CC(C=O)=CC1(C)O2)C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.016
InChIKey:QXDHLUAEQUYEIE-UHFFFAOYSA-N
ID: 27597
SMILES:CC1=CC(CC=C(C)C)(C(C)=C)OC(c2c(O)ccc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.541
InChIKey:IEWWHGAQLPNDED-UHFFFAOYSA-N
ID: 27598
SMILES:c12c(cc(C)cc1O)OC(CO)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.796
InChIKey:RARKGHFYSJYWAF-UHFFFAOYSA-N
ID: 27599
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 27600
SMILES:C12C(C=C(C)C)CC(C)C1C(c1c(=O)ccc(CCCCC)cc1O)OC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.929
InChIKey:IXMCBEJLQOUCQM-UHFFFAOYSA-N
ID: 27601
SMILES:Cc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.753
InChIKey:COOHZZAVBCYYCT-UHFFFAOYSA-N
ID: 27602
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C=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: 27603
SMILES:C1C(C)(C)Oc2c1c(O)cc(CCCCC)c2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -13.503
InChIKey:FJDRUZTWQAKHKS-UHFFFAOYSA-N
ID: 27604
SMILES:C(C=C(C)C)CC1(C)Oc2c(c(O)cc(CCC)c2)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 27605
SMILES:c1cc2c(cc1O)OC(C)(C)C1CCC(COC(C)=O)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.833
InChIKey:SYMAOTAXGZIKAD-UHFFFAOYSA-N
ID: 27606
SMILES:CC(C)c1c(O)c2c(c3c1OC(C(C)(O)C)C3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.116
InChIKey:ZYJMHYWNCBCPAE-UHFFFAOYSA-N
ID: 27607
SMILES:OC(=O)c1cc2c(cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -19.478
InChIKey:HNVKFYQXRFNXOU-UHFFFAOYSA-N
ID: 27608
SMILES:Oc1c(C(CC(C)C)=O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.439
InChIKey:MMBSMBBFKYDYEQ-UHFFFAOYSA-N
ID: 27609
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C(C)(O)C)OCC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.248
InChIKey:VSQUJQXJUWLGJE-UHFFFAOYSA-N
ID: 27610
SMILES:CCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.773
InChIKey:VVJUFZJKELLWGZ-UHFFFAOYSA-N
ID: 27611
SMILES:C(COS(CC)(=O)=O)([N+](=O)O)Cc1c2c(c(O)c(CC(C(=C)C)C)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.683
CB1 binding score: -15.929
InChIKey:FSLHQIOFPGZSHR-UHFFFAOYSA-O
ID: 27612
SMILES:CCCc1cc2ccc(O)c3c2c(c1)OC(C)(C)C1C3C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.457
CB1 binding score: -15.607
InChIKey:CHUYFLQRVFBXPP-UHFFFAOYSA-N
ID: 27613
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(C(CCCCCCCC=C)=O)ccc32)CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -16.217
InChIKey:MMYGWLTXKULMOI-UHFFFAOYSA-N
ID: 27614
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.596
InChIKey:RWFIRVYASWVANS-UHFFFAOYSA-N
ID: 27615
SMILES:CC1=CC2(O)C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.313
InChIKey:XIIAOXXFRJHRGJ-UHFFFAOYSA-N