ID: 19174
SMILES:C12C(O)(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.769
InChIKey:YKQWTCZDXOFGFC-UHFFFAOYSA-N
ID: 19175
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(C)C1OC(C(CC)C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.448
InChIKey:RENUNQGQQCPYKM-UHFFFAOYSA-N
ID: 19176
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c32)C1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -17.817
InChIKey:AAVGZFGYDPFYEH-UHFFFAOYSA-N
ID: 19177
SMILES:c1(CCCCC)c(O)cc(O)c2c1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.83
InChIKey:COAKPZCTWBXPLE-UHFFFAOYSA-N
ID: 19178
SMILES:C1(CCC=C(C)C)(C)Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.758
InChIKey:BBSLEQVLKFGGIE-UHFFFAOYSA-N
ID: 19179
SMILES:C(C)=Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -12.121
InChIKey:QNVISZMIZUHUAE-UHFFFAOYSA-N
ID: 19180
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC(O)C1(CO)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.531
InChIKey:KVZYDZFZSQDLFD-UHFFFAOYSA-N
ID: 19181
SMILES:c1c(O)c2c(cc1O)OC(C)(C)C1CC=C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: -16.615
InChIKey:SRNNAYVNIDFFPK-UHFFFAOYSA-N
ID: 19182
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 19183
SMILES:C1(c2c(O)cc(CC)cc2)C(C(C)(C)O)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -17.241
InChIKey:LDEFFAHGRLWCLP-UHFFFAOYSA-N
ID: 19184
SMILES:C1(=O)C(CC2C(C)(CC=CC(C)CCC=C(C)C)OC2=O)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -15.981
InChIKey:XJOVTBDLGDISLY-UHFFFAOYSA-N
ID: 19185
SMILES:C1C2C3C(C(=O)C2C)c2c(cc(CCCCC)cc2O)OC(C)(C1)C3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.792
InChIKey:YDGAVFXXAUTVOG-UHFFFAOYSA-N
ID: 19186
SMILES:C1C(O)C2(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(CCC=C(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.834
InChIKey:KAMFBENSDPSZQI-UHFFFAOYSA-N
ID: 19187
SMILES:C(COc1c(O)c2c(cc1O)C1C3C(C)(CCC3C(C)(C)O2)C1=O)(C)CCCC(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -16.722
InChIKey:YKYXPABUAWGNMM-UHFFFAOYSA-N
ID: 19188
SMILES:C12(C)CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C3C1C(C)CC(C=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -14.944
InChIKey:FMHIQTKHQGDLQU-UHFFFAOYSA-N
ID: 19189
SMILES:C1(C)(C)Oc2ccc(CCC=C)cc2C2CC(C)=CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.427
CB1 binding score: -15.155
InChIKey:NSDPVEWLISRSNB-UHFFFAOYSA-N
ID: 19190
SMILES:O=C(O)c1c2c(c(O)c(C)c1OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.806
InChIKey:YQXGRQBUORLJJR-UHFFFAOYSA-N
ID: 19191
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 19192
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1)CC(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.682
InChIKey:DVDIRFILNDHXDU-UHFFFAOYSA-N
ID: 19193
SMILES:C1(=O)CC2C(C)(C)Oc3c(cc(O)cc3C)C2C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -14.268
InChIKey:VIAGJWQYIMHJGS-UHFFFAOYSA-N
ID: 19194
SMILES:C1(C)=CC(CC(C)=CCc2cc(OC)cc(C)c2O)OC(C=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.443
InChIKey:AUHVAFOSAFQZJA-UHFFFAOYSA-N