ID: 85933
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C1CCC(C)=CCC=C2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.93
InChIKey:XCYJXCNAUNPGEF-UHFFFAOYSA-N
ID: 85934
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC=C(C)CCC=C(C)C)(C(O)=C(C)C(=O)C1=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -14.897
InChIKey:XPZWQSGQTCNMLB-UHFFFAOYSA-N
ID: 85935
SMILES:C(c1cc(CC=C)c2c(c1O)OC(C)(C)C1CCC(C)=CC12)(CCCCCC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.128
InChIKey:MJFXPUKOVZADTP-UHFFFAOYSA-N
ID: 85936
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 85937
SMILES:C(c1c2c(c(OC)c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.001
InChIKey:MTGSQWHCZSQATJ-UHFFFAOYSA-N
ID: 85938
SMILES:C1(C)(C)C2C(c3c(OC)cc(CCCCC)cc3O2)OC(C=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.726
InChIKey:ZXSAFMYWSWDXPY-UHFFFAOYSA-N
ID: 85939
SMILES:O=C1C(C)C2(C)C3C(Oc4c5c(cc(CCCC)c4)OC(C)(C)CC5C3)C(=O)C(C)(C)C2=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -13.844
InChIKey:VGUNRRZMVVKVCT-UHFFFAOYSA-N
ID: 85940
SMILES:CC(OC1CC2C(C)(C)Oc3cc(C)c(OC)cc3C2C=C1C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.502
InChIKey:RXGDOEAIWMSMEA-UHFFFAOYSA-N
ID: 85941
SMILES:c12cc(CCCCC)cc(O)c1OC13C(C(C)(C)OC1CC(C)=CC2)CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.986
InChIKey:BMXIOSLNRILPEV-UHFFFAOYSA-N
ID: 85942
SMILES:OCC1=CC2c3c(cc(CCCCCN=C)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.494
CB1 binding score: -14.937
InChIKey:DACQGVBFBLRPPW-UHFFFAOYSA-N
ID: 85943
SMILES:C(C(O)c1cc(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.093
InChIKey:WUOCORUXSPLCOB-UHFFFAOYSA-N
ID: 85944
SMILES:c1(COC)c(COC(CCc2ccc(O)cc2)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -13.768
InChIKey:PSTGAYJZSYQUHF-UHFFFAOYSA-N
ID: 85945
SMILES:C(=C(C)CC)C(C)C(C)c1c(O)c2c(cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.116
InChIKey:NPQOTLNTWONRAN-UHFFFAOYSA-N
ID: 85946
SMILES:C(C(C)=CCc1c(O)c2c(cc1O)C1CC(C)=CC(=O)C1C(C)(C)O2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.467
InChIKey:AYRIZNCUVRQMOQ-UHFFFAOYSA-N
ID: 85947
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C=C(C)C)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.293
InChIKey:YWWNXERPZHMYBW-UHFFFAOYSA-N
ID: 85948
SMILES:c1(CC2C(C(O)=C)CCC(C)C2)c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: Not available
InChIKey:RHPPNBMLFPXYQG-UHFFFAOYSA-N
ID: 85949
SMILES:C1(=O)C2Cc3c(c(O)c(OC(=O)C)c(CCCCC)c3)C1C(CCCC(C)C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.457
InChIKey:BWVIDAALXNEMRD-UHFFFAOYSA-N
ID: 85950
SMILES:C(CCC)Cc1ccc(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.441
InChIKey:VPIIPBDTVZXIEC-UHFFFAOYSA-N
ID: 85951
SMILES:C(=C(C)CCC=C(CCC=C(C)C)C)Cc1c(O)cc(CCc2ccc(O)cc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 85952
SMILES:CC1=CCCC(C)(C)C2C1c1c(O)cc(C)cc1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.645
InChIKey:MWLNRBXQYKHOCS-UHFFFAOYSA-N
ID: 85953
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N