ID: 37654
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(CCC(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 37655
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCC)c2)C2(O)C1CCC(C)(O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.317
InChIKey:JFABCPKQJXQZBU-UHFFFAOYSA-N
ID: 37656
SMILES:C=C(C)C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 37657
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 37658
SMILES:O=C(OCC)c1c2c(c(CCCCC)cc1OC)OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -11.803
InChIKey:BFXUQTXLLQZXCX-UHFFFAOYSA-N
ID: 37659
SMILES:C1CCC23c4c(cc(CCCCC)cc4O)OC(C)(C)C2C(C1P3)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.477
CB1 binding score: -14.262
InChIKey:FMQIJWXSDFUTND-UHFFFAOYSA-N
ID: 37660
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(OC)cc(O)c3C=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.044
InChIKey:GECVKMDKVSADDW-UHFFFAOYSA-N
ID: 37661
SMILES:C(CC)CCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 37662
SMILES:C1(c2c(O)cc(CCCCC)cc2O)CC(C)=CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 37663
SMILES:O=C(OC(C=C(C)C)CC(C)=CCCC(C)(O)C=CCC1(C)Oc2cc(O)c(OC)cc2C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -15.499
InChIKey:ZEJFBFVXDZVCFY-UHFFFAOYSA-N
ID: 37664
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)c1C2=C(C)C(=O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -13.935
InChIKey:OVGMTGCGHSKLHO-UHFFFAOYSA-N
ID: 37665
SMILES:Cc1c(-c2cc(C)cc(OCCC(CCC=C(C)C)C)c2)c(O)c2c(c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.766
CB1 binding score: -16.5
InChIKey:NXYJOXBVZVUGSZ-UHFFFAOYSA-N
ID: 37666
SMILES:CC(=CCc1c(OC)cc(CCCCC)c(C(=O)O)c1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -19.037
InChIKey:VAFRUJRAAHLCFZ-UHFFFAOYSA-N
ID: 37667
SMILES:O=C(c1c(CC=C(C)C)c2c(c(CCC(O)(C)C)c1O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.848
InChIKey:PJAIOOJFGZQIKZ-UHFFFAOYSA-N
ID: 37668
SMILES:C(CCCCCC)c1cc(O)c(CC=C(C)CCC=C(C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 328.54
CB1 binding score: -16.438
InChIKey:NCVJPHDWAQCELV-UHFFFAOYSA-N
ID: 37669
SMILES:C(Cc1c(CO)c2c(c(O)c1C=O)OC(C)(C)C1CC=C(C)CC12)CCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.827
InChIKey:UEQAYZOYTKNWEX-UHFFFAOYSA-N
ID: 37670
SMILES:CCCCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 37671
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(=CCC=C(C)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -17.79
InChIKey:QPICVVIPKMJRLT-UHFFFAOYSA-N
ID: 37672
SMILES:c1(O)c(CC2C(C)=CCC3C(C)(C)Oc4c(c(O)cc(C)c4)C23)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -14.239
InChIKey:CGOHYHVYIMNGPO-UHFFFAOYSA-N
ID: 37673
SMILES:c1(CCCC)cc(O)c(C2C=C(C)CCC2C(C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -19.478
InChIKey:UELYWRAKVJEDIL-UHFFFAOYSA-N
ID: 37674
SMILES:C12C(C(O)C(=C)CC1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.502
InChIKey:HDNJNVPZXVJOMB-UHFFFAOYSA-N