ID: 103468
SMILES:Oc1c(C2C(C(C)C)CCC(C)=C2)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 300.486
CB1 binding score: -18.255
InChIKey:FVMNSBXLYRKHTD-UHFFFAOYSA-N
ID: 103469
SMILES:C(=C)C12c3c(cccc3)OC(C)(C)C1CC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 254.373
CB1 binding score: -14.288
InChIKey:JPRCHKCOLGRFAC-UHFFFAOYSA-N
ID: 103470
SMILES:Oc1c(CC=C(C)CCC=C(C)C)cc(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.051
InChIKey:TXLIVWXFPYVBTA-UHFFFAOYSA-N
ID: 103471
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 103472
SMILES:C(CCC(=CCc1c(O)cc(CCC)cc1O)C)C(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -18.088
InChIKey:OEGUJXLLNWKNBN-UHFFFAOYSA-N
ID: 103473
SMILES:Oc1cc(CCCCC)cc2c1C1OC3C(C)(C)C2(C3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.912
InChIKey:LQZJOSCUMVPYMK-UHFFFAOYSA-N
ID: 103474
SMILES:C1(Cl)C(C)(O)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.929
CB1 binding score: -15.218
InChIKey:WOXGGIBTABLAQI-UHFFFAOYSA-N
ID: 103475
SMILES:C(CCCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -17.54
InChIKey:CLIPUAZVFGVGBH-UHFFFAOYSA-N
ID: 103476
SMILES:C1C(OC(=O)C(C)CC)C2C(C=C(C)C1)c1c(cc(CCCCC)cc1O)OC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -16.697
InChIKey:DCWAYAVOPKTBSQ-UHFFFAOYSA-N
ID: 103477
SMILES:Oc1cc(C)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 103478
SMILES:C(C)CCCc1cc(O)cc(OCC=C(CC(C=C(C)C)=O)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.636
InChIKey:CLVHHOHTELKJGO-UHFFFAOYSA-N
ID: 103479
SMILES:CC1(C)OC2C1COc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.549
InChIKey:CJOKEKLQMPOZRF-UHFFFAOYSA-N
ID: 103480
SMILES:C12C(CC=C1C)C(C)(C)Oc1c2c(O)cc(CCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.43
InChIKey:LZMOSAICMFWKKD-UHFFFAOYSA-N
ID: 103481
SMILES:C(=C(C)C)CCC(=CCCC1(C)C=Cc2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 103482
SMILES:C1(O)C(=O)C2=C(c3c(cc(CCCCC)cc3OC)OC(C)(C)C2=C)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -12.97
InChIKey:FFHJQCRNXMMAPI-UHFFFAOYSA-N
ID: 103483
SMILES:CC1(C)Oc2cc(O)cc(C)c2C2CC(C)=CC(=O)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.545
InChIKey:SFQALSMFMHKNDQ-UHFFFAOYSA-N
ID: 103484
SMILES:C1C(C)=Cc2c(O)c(C(OC)=O)c(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -10.739
InChIKey:BTRAMHKJNWXMPO-UHFFFAOYSA-N
ID: 103485
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 103486
SMILES:c1(C=O)c2c(c(O)c3c1C(C)CCC3)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -12.928
InChIKey:QUYSAAZZFUKUEA-UHFFFAOYSA-N
ID: 103487
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 103488
SMILES:C1C(C)(C(=O)OC)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.528
InChIKey:DBMUQRHDGBSEGV-UHFFFAOYSA-N