ID: 116257
SMILES:C1(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(OC)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 116258
SMILES:C(c1c2c(ccc1O)OC(C)(C)C1C2CC(C)=CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.608
InChIKey:BYEHSZDDHSNSON-UHFFFAOYSA-N
ID: 116259
SMILES:C1CC(C(C)=C)CC2C(C)(Oc3c(C(O)(C[N+](C)(C)C)C)c(C)cc(O)c3C(=O)CC12C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.663
CB1 binding score: -17.91
InChIKey:XRIIJLHPHJWKNP-UHFFFAOYSA-O
ID: 116260
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC=C(C)C1=O)C(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.732
InChIKey:SSOYLLVFNTWATB-UHFFFAOYSA-N
ID: 116261
SMILES:O=C1Oc2c(O)cc(CCCCC)cc2OC1(C)CCC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.776
InChIKey:MRYWICCCJXDMSJ-UHFFFAOYSA-N
ID: 116262
SMILES:c1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.988
InChIKey:FDECQIAQAVZRFF-UHFFFAOYSA-N
ID: 116263
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 116264
SMILES:C12(C)CC(CC(C)(O)C)Oc3c1c(CCCCC)cc(OC)c3O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -16.144
InChIKey:ZDXQZMCAPGQEEM-UHFFFAOYSA-N
ID: 116265
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 116266
SMILES:c1(C(=O)C)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.068
InChIKey:CPZWKXRSBORARS-UHFFFAOYSA-N
ID: 116267
SMILES:O1C(=O)C(COC(=O)C)=CC1c1c(O)cc(CCCCC)cc1OC1OC(CO)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.509
CB1 binding score: -12.486
InChIKey:YXVHUGBEVXLDEK-UHFFFAOYSA-N
ID: 116268
SMILES:C1(Oc2c(O)c3c(cc2CCCCC)OC(C)(C)C2C3CCC2=C)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.325
InChIKey:KVLYDEMQJLWWMX-UHFFFAOYSA-N
ID: 116269
SMILES:CC1(O)C2C(CC1)C(C)(C)Oc1c2c(OC)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.804
InChIKey:NPQSLCCVAOCPED-UHFFFAOYSA-N
ID: 116270
SMILES:C12C(=C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.729
InChIKey:VHYDABIFTJKCRR-UHFFFAOYSA-N
ID: 116271
SMILES:c12c(c3c(cc1)OC(C)(C)C=C3)C1C(C(C)(C)Oc3cc(O)ccc3C1=O)CC2CC(CC(CC(CCO)=O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.731
CB1 binding score: -14.262
InChIKey:FGEFWHBRULLLKI-UHFFFAOYSA-N
ID: 116272
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 116273
SMILES:O1C(C=C(CO)C)CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.588
InChIKey:ZDXAGHBKAZYBRH-UHFFFAOYSA-N
ID: 116274
SMILES:c12ccc(SC)cc1OC(C)(C)C1CCC(CO)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.428
CB1 binding score: -14.128
InChIKey:RVIOSALZPHLZQV-UHFFFAOYSA-N
ID: 116275
SMILES:C1(C)=CCC2C1(c1c(O)cc(COC)cc1OC)CC(O)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.588
InChIKey:CHJZPVPNKKDLQA-UHFFFAOYSA-N
ID: 116276
SMILES:O1c2cc(CCC)cc(O)c2C=CC1(C)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -18.68
InChIKey:RFSBDKOBPVLAOQ-UHFFFAOYSA-N
ID: 116277
SMILES:C(C=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(C=C)OC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.71
InChIKey:AVIDLNKXUCOKJQ-UHFFFAOYSA-N