ID: 78415
SMILES:O=C(CCC(O)(CC(c1c2c(ccc1O)OC(C)(C)C1C2C=C(C)CC1)=O)Cl)Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 441.351
CB1 binding score: -12.743
InChIKey:VIFMHCDJTXVJBQ-UHFFFAOYSA-N
ID: 78416
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 78417
SMILES:C1(Oc2c(CCCCC)cc(O)cc2CC=C(CCC=C(C)C)C)C(O)C(O)C(O)C(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.627
CB1 binding score: -16.57
InChIKey:DUAFPNXAFDCUQF-UHFFFAOYSA-N
ID: 78418
SMILES:C(CCCC)c1cc2c(c(O)c1C(OCC)=O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.956
InChIKey:ZCSSKLZKPLWEMS-UHFFFAOYSA-N
ID: 78419
SMILES:C1C2(C)CC3c4c(O)cc(CCCCC)cc4OC(C3(C)CC1)CC2C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.115
InChIKey:WZIMRNSDWBOESZ-UHFFFAOYSA-N
ID: 78420
SMILES:c12c(O)ccc(OC(CC(C)C)=O)c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.116
InChIKey:LOGAVHUAXWYOTJ-UHFFFAOYSA-N
ID: 78421
SMILES:CC1(C)C(Oc2cc(C(C)(CCCCCCC)C)ccc2O)CCCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.582
CB1 binding score: -13.634
InChIKey:VMWLOFAVXNVWFX-UHFFFAOYSA-N
ID: 78422
SMILES:C123C(CCC1COC)c1c(cc(CCCCC)cc1O)OC2OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.184
InChIKey:AZRNLJMJKRFTFQ-UHFFFAOYSA-N
ID: 78423
SMILES:Oc1c(CCCCC)cc2c(c1OC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.234
InChIKey:RWFYLGOMIZEREN-UHFFFAOYSA-N
ID: 78424
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 78425
SMILES:C1C(CO)=C2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1C(CO)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.81
InChIKey:WVTRHELGELKNID-UHFFFAOYSA-N
ID: 78426
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N
ID: 78427
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 78428
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 78429
SMILES:C(COc1c(CCC(O)=O)ccc2c1OC(C)(C)C1CCC(C)=CC12)(C(O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -12.382
InChIKey:RJHDQPOPAJCYSD-UHFFFAOYSA-N
ID: 78430
SMILES:CC1(C)Oc2cc(C(OC)=O)c(C)cc2C2C=C(C(C)C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 328.452
CB1 binding score: -14.107
InChIKey:VPFFJYRHMJNRMV-UHFFFAOYSA-N
ID: 78431
SMILES:C1c2c(O)cc(CC)cc2OC(C)(C)C2CC(OC(=O)C)C(C)=C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.12
InChIKey:MVYPQXMZJRGESL-UHFFFAOYSA-N
ID: 78432
SMILES:O1C2(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.352
InChIKey:YTVFMKSRHMNBGC-UHFFFAOYSA-N
ID: 78433
SMILES:CC(C=C1c2c(O)c3c(cc2C(=O)C(CC=C(CCC=C(C)C)C)(C)O1)OC(C)(C)C1C3C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.738
CB1 binding score: -15.552
InChIKey:XRWPJGGNMSHNJY-UHFFFAOYSA-N
ID: 78434
SMILES:C(CCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 342.523
CB1 binding score: -18.105
InChIKey:APNLZBJARSTBFQ-UHFFFAOYSA-N
ID: 78435
SMILES:Oc1c(C=O)c(CCCCC)cc2c1C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.98
InChIKey:HKQTWYXNIOJLSJ-UHFFFAOYSA-N