ID: 51598
SMILES:c1(CCCCC)cc2c(c(O)c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 51599
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C3C(C)(O3)CC(O)CC(C)(C)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.132
InChIKey:XVQIIKNMAATCLC-UHFFFAOYSA-N
ID: 51600
SMILES:C1CC2C(O)(C(Cl)C1(C)C)c1c(cc(CCCCC)c(C(=O)O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.965
CB1 binding score: -14.73
InChIKey:IHXDNLVQOCHJQP-UHFFFAOYSA-N
ID: 51601
SMILES:Cc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.387
InChIKey:VVRJCBBASZRUGL-UHFFFAOYSA-N
ID: 51602
SMILES:CC(C1CC(=O)C(C)(C)C1c1c(O)cc(CCCCC)cc1O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.314
InChIKey:WNKBZVDYWRUFBI-UHFFFAOYSA-N
ID: 51603
SMILES:C(C1C2C(C=C(C)CC2)c2c(cc(CCCCC)cc2O)O1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.523
InChIKey:GIXTYNPJHKIQSQ-UHFFFAOYSA-N
ID: 51604
SMILES:Cc1c(O)c(C(CC(C)C)=O)c(O)c2c1OC(CCC=C(C)C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.975
InChIKey:QVVGPZWNTBTVFM-UHFFFAOYSA-N
ID: 51605
SMILES:Oc1c(CCCCC)cc(O)c(CC2=C(C)CC(C)(C)CC2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.234
InChIKey:BSBHVPALPZWEBU-UHFFFAOYSA-N
ID: 51606
SMILES:C12(O)C(CCC(C)=C1)C(C)(C)Oc1c2c(O)cc2c1C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -13.074
InChIKey:SAGYWEMYRHDTFO-UHFFFAOYSA-N
ID: 51607
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C)C1CC(=O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.015
InChIKey:OPIWYSZGIONMJV-UHFFFAOYSA-N
ID: 51608
SMILES:c1(C(=O)O)c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 51609
SMILES:C(CCc1c(O)cc(O)c2c1OC1(C)C(C(C)(C)CCC1)C2)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -13.078
InChIKey:GWVSSIYXFUFDNM-UHFFFAOYSA-N
ID: 51610
SMILES:C(OC(C)=O)C1=CC2C(C(C)(C)Oc3c(C(=O)C(C)CC)c(OC)cc(C(C(=O)OC)C)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -16.869
InChIKey:NNSDEPPLYIRETN-UHFFFAOYSA-N
ID: 51611
SMILES:c12c(cc(CCCCC)cc1O)OC(CCCC(C)(C)O)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.319
InChIKey:WCYGYBLVAJEPSX-UHFFFAOYSA-N
ID: 51612
SMILES:C1=C(C)COc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -17.881
InChIKey:HZTBOQLZTCDDEK-UHFFFAOYSA-N
ID: 51613
SMILES:C1C(C)=CC(O)C(C(=C)C)CCC(CO)CC1c1c(O)cc(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.398
InChIKey:NCLQAETTXFASGG-UHFFFAOYSA-N
ID: 51614
SMILES:CC(OC1C2C(CCC1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.665
InChIKey:QGCMZLCMJQZIRM-UHFFFAOYSA-N
ID: 51615
SMILES:OC(CCc1cc(CC=C(CCC=C(C)C)C)c(O)c(O)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.866
InChIKey:OFUSCMKMQDATHX-UHFFFAOYSA-N
ID: 51616
SMILES:c1c(O)c(-c2ccc(CCCCC)cc2)c(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -15.722
InChIKey:OEIRHYHWZVUEMB-UHFFFAOYSA-N
ID: 51617
SMILES:C(CCC(C)=CC(O)c1c(O)c(C(=O)O)c(CCCCC)cc1O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.688
InChIKey:YRZLPNRLKWJDMW-UHFFFAOYSA-N
ID: 51618
SMILES:C(c1cc(O)c2c(c1)OC1(C)C3CC3C(C)(C)C12)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -13.069
InChIKey:KHVUIEBBMUORIX-UHFFFAOYSA-N