ID: 118168
SMILES:C1(C)C2(Oc3c1c(O)cc(CCCC)c3)C(CCC=C(C)C)(C)C(CC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 410.642
CB1 binding score: -16.217
InChIKey:FEQRKTQESNDSJO-UHFFFAOYSA-N
ID: 118169
SMILES:C12(C)C(C(C)(C)OC(=O)C(=C3COC(=O)C3)C1)CC(=O)C2Cl
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.776
CB1 binding score: -14.342
InChIKey:KHFXBIALCWLDGO-UHFFFAOYSA-N
ID: 118170
SMILES:C(C)(=CCCC(=CCCC(C)=CCc1cc(O)c(CC(O)=O)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids;Tetraketide meroterpenoids
MW: 372.505
CB1 binding score: -18.306
InChIKey:BDRGSNYWOXCBFU-UHFFFAOYSA-N
ID: 118171
SMILES:C1CC(C)=CCC1C(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.608
InChIKey:UWRBECZWNNFRIH-UHFFFAOYSA-N
ID: 118172
SMILES:O=C(C=C(C)C)c1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.185
InChIKey:JYVGNGFQOHLABK-UHFFFAOYSA-N
ID: 118173
SMILES:C1(=O)C(O)=C2C(C)(Oc3cc(O)cc(CCC)c31)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -17.039
InChIKey:CQGUFCCYEVZHJR-UHFFFAOYSA-N
ID: 118174
SMILES:C1(O)(C)CCC(C(=C)C)C2Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.975
InChIKey:OCDOFZITOWPDMG-UHFFFAOYSA-N
ID: 118175
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)ccc(CCN(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 299.458
CB1 binding score: -16.653
InChIKey:BWFYWNBXDAQNNZ-UHFFFAOYSA-N
ID: 118176
SMILES:C1(=O)C(CC=C(C)C)(Oc2c(O)cc(CCC)cc2OC)CCC(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.042
InChIKey:HLPLRJFLGOSXDU-UHFFFAOYSA-N
ID: 118177
SMILES:C1(C)(C)Oc2cc(O)cc(C)c2C2C13CC=C(C)C32
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -14.922
InChIKey:CGVJJUCWBJLRML-UHFFFAOYSA-N
ID: 118178
SMILES:C1C(C(=C)C)CCC2(C)Oc3c(c(O)cc(C)c3)C12C=CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.491
InChIKey:MRPKZQJZOJMJDC-UHFFFAOYSA-N
ID: 118179
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)=CC1)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.871
InChIKey:HLOAIJZUTIQFKA-UHFFFAOYSA-N
ID: 118180
SMILES:C(C)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c2c1OC(C)(CCC=C(C)C)C=C2c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.762
CB1 binding score: -15.383
InChIKey:UPGQQWRABFKKGB-UHFFFAOYSA-N
ID: 118181
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C(OC)=O)=CCC1C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.465
InChIKey:YZQKMPYEOVMRON-UHFFFAOYSA-N
ID: 118182
SMILES:C(O)(C)(C(O)CCC(C)=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.499
CB1 binding score: -18.15
InChIKey:OWSPBIWYEIHDKZ-UHFFFAOYSA-N
ID: 118183
SMILES:c1c(CCCCC)cc2c(c1O)-c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 118184
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 118185
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 118186
SMILES:C1(C)CC2C(C1)C(C)(C)Oc1cc(CCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.001
InChIKey:UDUDKCIJACMYFB-UHFFFAOYSA-N
ID: 118187
SMILES:c1cccc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 118188
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CC1(C)C(O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.499
InChIKey:CGQGMHAWQKTIIS-UHFFFAOYSA-N