ID: 87172
SMILES:c12c(oc(C(=O)C(CCCC(C)(O)COC(C)=O)C)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -19.918
InChIKey:MMBRPBJDNDHRGF-UHFFFAOYSA-N
ID: 87173
SMILES:C1(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C2C1CCC1(C)C2CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.628
InChIKey:RJHJLYXMFGGWID-UHFFFAOYSA-N
ID: 87174
SMILES:CC1(C)C2C(C)(Oc3c(c(O)cc(CCC)c3)C2O)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.645
InChIKey:BBIKWTSQEKKAKO-UHFFFAOYSA-N
ID: 87175
SMILES:C1CC(C(C)=C)C(c2c(O)cc(O)c(C=O)c2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.527
InChIKey:KAIPVMUFFCVRIG-UHFFFAOYSA-N
ID: 87176
SMILES:c1(N)cc(CCCCC)cc2c1C1C=CC(O2)C(O)C=C(C(CCC(OC)C(C)=C)(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 453.667
CB1 binding score: -17.683
InChIKey:YGIBXKDFPJZQAO-UHFFFAOYSA-N
ID: 87177
SMILES:C1C2(C)Oc3c(c(OC4C(O)C(O)C(O)C(CO)O4)cc(CCCCCC)c3)C2C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.653
CB1 binding score: -13.939
InChIKey:VEYVELJAMXNLGW-UHFFFAOYSA-N
ID: 87178
SMILES:C1(C)(CCC=C(C)C)Oc2c(c(O)cc(CCC)c2)C=C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.922
InChIKey:IMBXYMXLUCZQAG-UHFFFAOYSA-N
ID: 87179
SMILES:C12C(C(C)O)CC(C)(C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.072
InChIKey:KKUIJLQGIUDGEH-UHFFFAOYSA-N
ID: 87180
SMILES:c1c(O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.561
InChIKey:RRHAEGQFRQNVHT-UHFFFAOYSA-N
ID: 87181
SMILES:CCCCCCc1cc(O)c(C2C=C(C)CCC2C(CCC=C(CO)C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.261
InChIKey:WKIYPYNOHZGABG-UHFFFAOYSA-N
ID: 87182
SMILES:C(C=C(C)C)CC1(C)Oc2cc(CCCCC)c(C(OC)=O)c(OC)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.465
InChIKey:ZGWWAZYYKSZKEP-UHFFFAOYSA-N
ID: 87183
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(CCCc2cocc2)(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.797
InChIKey:ZHFWWHUGDFKLRF-UHFFFAOYSA-N
ID: 87184
SMILES:CC(=CCCC1(C)Oc2cc(CCCCC)c(O)c3c2C1CC(C)C3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -12.188
InChIKey:RHRFNEMWSZGWGH-UHFFFAOYSA-N
ID: 87185
SMILES:C(C)CCCc1cc(O)c2c(c1)OC1(C)C(C2)C=COC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.605
InChIKey:NIKYOYKLBCOERI-UHFFFAOYSA-N
ID: 87186
SMILES:C1=CC2c3c(cc(CCCCC)cc3OC(C)=O)OC(C)(C)C(C1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -13.796
InChIKey:DOPVKSDRUDNPQM-UHFFFAOYSA-N
ID: 87187
SMILES:Oc1c(C=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 87188
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 87189
SMILES:C12C(COc3ccccc3)=CC3c4c(cc(CCCCC)cc4O)OC(C)(C)C3CC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.658
CB1 binding score: -10.689
InChIKey:SCDLAEFOHWEWFS-UHFFFAOYSA-N
ID: 87190
SMILES:CC(C)(C1C(c2c(O)cc(CCCC)cc2O)C(C(=C)C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.682
InChIKey:CYNAHOCDCKNYFD-UHFFFAOYSA-N
ID: 87191
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C2C1(C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.104
InChIKey:VLPPLJISZMSQBA-UHFFFAOYSA-N
ID: 87192
SMILES:C1(OC(C)=O)C(C)=CC2c3c(cc(C)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.527
InChIKey:YVROCDBNRUAEDW-UHFFFAOYSA-N