ID: 48469
SMILES:C(CCCCC)c1cc(O)cc2c1OC(C)(C)C1C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.315
InChIKey:LGUBMFTVQAAWMD-UHFFFAOYSA-N
ID: 48470
SMILES:CC1(CC(C)C)c2c(O)cc(CCCCC)cc2OC(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -8.45
InChIKey:XSTPNGOTNXOTJR-UHFFFAOYSA-N
ID: 48471
SMILES:Oc1cc(CCC)cc2c1C1C3C(O)(C1CC(C(=C)C)CCC3C)C(=O)C(C)(C)C1CCC1(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -16.813
InChIKey:ABZNXJOYVAJZLX-UHFFFAOYSA-N
ID: 48472
SMILES:C1CC(C(C)=C)C(c2c(OC)c(OC)ccc2)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.754
InChIKey:BPKVPHCRXMFJSH-UHFFFAOYSA-N
ID: 48473
SMILES:O1C(=O)CC2OC(C)(C)C(C=CC(C)=CCc3c(O)c(C)cc(OC)c3)=CC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -18.011
InChIKey:ZGBAMFDRSVMYIX-UHFFFAOYSA-N
ID: 48474
SMILES:C(CC(CCOc1cc2c(cc1O)C1C(C(C)(C)O2)CCC(C)=C1)C=O)c1ccc(O)c(C2C=C(C)CCC2C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 602.812
CB1 binding score: -15.801
InChIKey:WRHISEPNFRXILK-UHFFFAOYSA-N
ID: 48475
SMILES:C1(C)=CCC(C)(C)C=CCC2(C)Oc3c(c(OC(=O)C)cc(CCCCC)c3)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -16.019
InChIKey:AGIYMCOUFXREGC-UHFFFAOYSA-N
ID: 48476
SMILES:C1(C)=CCC2C(C1)c1c(cc(O)cc1C)OC2(O)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.076
InChIKey:GTVMZNRUWVXMOH-UHFFFAOYSA-N
ID: 48477
SMILES:Oc1c(C(C(C)CC)=O)c(O)c2c(c1O)C1C(C(C)(C)O2)CC=C(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.904
InChIKey:PWUNAINXBLAADB-UHFFFAOYSA-N
ID: 48478
SMILES:C(CC(C)CC)(O)c1cc2c(c(O)c1)C1CC(C(C)C)C3OC(C1O2)C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -12.209
InChIKey:YJRGXSPSBWPZCG-UHFFFAOYSA-N
ID: 48479
SMILES:C(CCCc1ccc(O)c(CC=C(C)CCC=C(C)C)c1C(O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.474
InChIKey:JCQSVNJYGANRDZ-UHFFFAOYSA-N
ID: 48480
SMILES:CCCCCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 48481
SMILES:CC1(C)C2CCC(C)=CC2c2c(cc(CCCCCO)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 48482
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 48483
SMILES:COc1cc(C)c(C2C=C(C)CCC2C(=C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.969
InChIKey:INWRNKWJCRNMBB-UHFFFAOYSA-N
ID: 48484
SMILES:C1C2C=C(C)C(=O)CC2C(C)(C)Oc2cc(C)ccc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -16.938
InChIKey:HCAIUELDJRSMEN-UHFFFAOYSA-N
ID: 48485
SMILES:C(=CCCC1(C)Oc2cc(C)c(Cl)c(O)c2C=C1)C(CCC1OC1(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.935
CB1 binding score: -15.913
InChIKey:RWUPQBYBBRYHDY-UHFFFAOYSA-N
ID: 48486
SMILES:O(C(=O)CCC(O)=O)CCCCc1c2c(ccc1C)C1C(CCC(=C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.716
InChIKey:VZJZRGNUHAWNIV-UHFFFAOYSA-N
ID: 48487
SMILES:C12C(c3c(cc(CCC(C)OC)cc3O)OC1(C)C)OC(C(C)(O)C)CC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -12.906
InChIKey:OPAPZMZSNSGRIA-UHFFFAOYSA-N
ID: 48488
SMILES:C(C)Cc1cc(OC)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.288
InChIKey:DOMAEJIZGPNRFZ-UHFFFAOYSA-N
ID: 48489
SMILES:C1C(C)(COC(C)=O)CC2C3c4c(cc(CCCCC)cc4OC3(C)C(O)CC12)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -17.367
InChIKey:ODKBOCBYTPIBGG-UHFFFAOYSA-N