ID: 4474
SMILES:CC1=CC(c2c(O)c(C(=O)O)c(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -18.276
InChIKey:NGHGOJRQIYPXBS-UHFFFAOYSA-N
ID: 4475
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1=C2C2=C(C(C)(C)CCC2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -15.427
InChIKey:SBFQYQASMAORKY-UHFFFAOYSA-N
ID: 4476
SMILES:C(O)C1=CC2C(C(C)C)CCC3(C)OC13c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.168
InChIKey:CBKYZICAHYQVDE-UHFFFAOYSA-N
ID: 4477
SMILES:c1(CCCC)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 4478
SMILES:C1CC(C)(C)C(c2c(OC(=O)C)cc(CCCCC)cc2O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.759
InChIKey:AKZWPMNIPRWBQX-UHFFFAOYSA-N
ID: 4479
SMILES:OC(C(CCCC(C)(O)C)(C)O)Cc1c2c(ccc1O)OC(C)(C)C1CCC(C)=CC1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.6
CB1 binding score: -15.116
InChIKey:FHXXCUGPTJIIIE-UHFFFAOYSA-N
ID: 4480
SMILES:C1c2c(c3c(cc2C)OC(C)(C)C=C3)C=C(C(CCC=C(C)COC(CC(C)C)=O)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -13.114
InChIKey:CYCGDSWTWPCHAM-UHFFFAOYSA-N
ID: 4481
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -18.437
InChIKey:LAYJCXVNCKEKDA-UHFFFAOYSA-N
ID: 4482
SMILES:C1C2(C(C)C)Oc3c(c(O)cc(CCCCC)c3)C1C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.216
InChIKey:OASXXWCKHDPCDP-UHFFFAOYSA-N
ID: 4483
SMILES:C1(c2c(O)cc(CCCCCO)c(C(=O)CC(C)C)c2)OC(C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.745
InChIKey:KIBBSTPUEDOHKB-UHFFFAOYSA-N
ID: 4484
SMILES:Cc1c2c(c(O)c3c1OC(C)(C)C1C3C=C(CO)CC1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.33
InChIKey:WMLPOINVQFKHEC-UHFFFAOYSA-N
ID: 4485
SMILES:c1(O)cc(CCCCC)cc2c1C1C(O)(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.016
InChIKey:DYJVRFKTUHQJIG-UHFFFAOYSA-N
ID: 4486
SMILES:CC(C(Oc1cc(CCCCC)ccc1C1(C)CCCC1(C)C)=O)CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.647
CB1 binding score: -16.55
InChIKey:VAAROHNKSUZXSQ-UHFFFAOYSA-N
ID: 4487
SMILES:c1(CCCC)cc2c(c(O)c1Cl)C1C(CC(C(=C)C)C1)CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.941
CB1 binding score: -14.934
InChIKey:XDOQIAVDCCJEQA-UHFFFAOYSA-N
ID: 4488
SMILES:Cc1c(O)cc(OC)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.717
InChIKey:SIHQMOJLPZOWKK-UHFFFAOYSA-N
ID: 4489
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 4490
SMILES:O=Cc1cc2c(cc1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -15.897
InChIKey:FWGDNADOUIXPFJ-UHFFFAOYSA-N
ID: 4491
SMILES:C1(=O)CC(C(C)=C)C(c2ccc(CCCCCC)cc2)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -13.097
InChIKey:OFCCPEVIGPJCQC-UHFFFAOYSA-N
ID: 4492
SMILES:C1=CC(C)(CCC=C(C)C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 4493
SMILES:C1=C(CO)CC2c3c(O)cc(CCCCC)c(OC(C)=O)c3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.975
InChIKey:DCZIIGYPTAIHMG-UHFFFAOYSA-N
ID: 4494
SMILES:C(=C)(C=CCC(=CCc1c(O)c(C)cc(O)c1)C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.881
InChIKey:XJGZQRUFAFFUAF-UHFFFAOYSA-N