ID: 107668
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 107669
SMILES:CC(C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 107670
SMILES:c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.281
InChIKey:KZTIITBECKQIPO-UHFFFAOYSA-N
ID: 107671
SMILES:c1(O)cccc(CCc2cc(O)c3c(c2)OC(C)(C)C2CCC(C)=CC23)c1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 364.485
CB1 binding score: -16.591
InChIKey:NMXKDIUBEUGJJQ-UHFFFAOYSA-N
ID: 107672
SMILES:C(CCCc1cc2c(c(O)c1)C13C(=C(C)C(C2)CC1=O)CC(C(C)=C)CC3)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -15.062
InChIKey:TYANXVXKJIOZGW-UHFFFAOYSA-N
ID: 107673
SMILES:C1C2(C)C(CC(C(C)C)C1)Oc1cc(CCCCC)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.529
InChIKey:YFONDPLGTGMLSQ-UHFFFAOYSA-N
ID: 107674
SMILES:COc1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 107675
SMILES:c12cc(C)c(CCCCC)cc1OC(C)(C)C(O)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -16.192
InChIKey:MGMJYILQRRNRIT-UHFFFAOYSA-N
ID: 107676
SMILES:c1(C#CC(C)=C)c(O)cc(OC)c(CC=C(C)CCC=C(C)C)c1C1C(C(C)=C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.686
CB1 binding score: -14.202
InChIKey:LLTQOGVSGGRZEI-UHFFFAOYSA-N
ID: 107677
SMILES:C12(Oc3c1c(O)cc(CCC)c3)OC(C(C)(O)C)CC2(CC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.063
InChIKey:CRYAQNMGISVBNL-UHFFFAOYSA-N
ID: 107678
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C(O)C2)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -14.608
InChIKey:PKVMLFINZXXRHT-UHFFFAOYSA-N
ID: 107679
SMILES:C1(C=O)=CCc2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.029
InChIKey:RXTVZVUIEPAOEQ-UHFFFAOYSA-N
ID: 107680
SMILES:CC(CCC=C(C)C)=CCCC(OC(c1c(O)cc(CCC)cc1O)=O)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.997
InChIKey:BRTBXUUCAFVPKT-UHFFFAOYSA-N
ID: 107681
SMILES:c1c(C23C(C(C)CC2)CCC(C)=C3)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -14.737
InChIKey:LJFKJNDBEKZLCX-UHFFFAOYSA-N
ID: 107682
SMILES:C(CC)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 107683
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)c3ccc(C)c(C)c3O1)CC2)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.637
CB1 binding score: -11.695
InChIKey:IAEWQIRBXKXCRE-UHFFFAOYSA-N
ID: 107684
SMILES:CC(C=CC(C(C)C(=O)c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1O)=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.498
CB1 binding score: -15.682
InChIKey:WNACGCWZLYIGFD-UHFFFAOYSA-N
ID: 107685
SMILES:c1c(O)c2c(cc1CCC)OC1(C)C(C2(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.327
InChIKey:BPLCRNPQGRCHIJ-UHFFFAOYSA-N
ID: 107686
SMILES:Oc1cc2c(cc1CO)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.666
InChIKey:OLGUDSBZAYIQMS-UHFFFAOYSA-N
ID: 107687
SMILES:C1C(C)COc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.588
InChIKey:NGWFDQUUPDZYQO-UHFFFAOYSA-N
ID: 107688
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -16.916
InChIKey:WYMHNQJFXXXJDX-UHFFFAOYSA-N