ID: 86080
SMILES:CC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 86081
SMILES:C1(C)=C2C(CC1)C(C)(C)Oc1c(c(O)cc(C)c1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.191
InChIKey:VOIYVDAZBNDYSX-UHFFFAOYSA-N
ID: 86082
SMILES:c1(C2C=C(CCC=C(C)C)C(=O)O2)c(O)cc(CCCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.893
InChIKey:ZUAOOUGELYBQQE-UHFFFAOYSA-N
ID: 86083
SMILES:c1(O)c2c(cc(C(C)(CCCCCC)C)c1)OC(C)(C)C1CCC(O)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -15.525
InChIKey:JGWRTCPQNMHFJM-UHFFFAOYSA-N
ID: 86084
SMILES:C1C(C(=C)C)C(c2cc(CCN(C)C)ccc2O)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 299.458
CB1 binding score: -17.957
InChIKey:JVTBDUWWCYUSCG-UHFFFAOYSA-N
ID: 86085
SMILES:c1(CC=C(CCC=C(C)C)C)cc(O)c2c(c1)OC(C)(C)C1C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.62
InChIKey:PLTWNQNJQLVHRG-UHFFFAOYSA-N
ID: 86086
SMILES:c1c(CCCCCC)cc(O)c2c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 86087
SMILES:CC12C(C)=CCCC1C(CC1=C(c3c(O)c(C(O)=O)c(CCCCC)cc3O)OC1c1ccc(O)cc1)C(O)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.73
CB1 binding score: -15.301
InChIKey:MIJZFZLQWHHFLS-UHFFFAOYSA-N
ID: 86088
SMILES:C1C(C)C2C(c3c(OC(=O)CC(C)C)cc(CCCCC)cc3O2)OC1C=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -13.401
InChIKey:LIBDKANBDJTLHZ-UHFFFAOYSA-N
ID: 86089
SMILES:c1c([N+](=O)[O-])c(CCCCC)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.483
CB1 binding score: -14.328
InChIKey:XYARPFPWWGCRKV-UHFFFAOYSA-N
ID: 86090
SMILES:C1(C)=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 86091
SMILES:C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(CO)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.402
InChIKey:SBYLAXLLWUSPDM-UHFFFAOYSA-N
ID: 86092
SMILES:CC(C)=CC(CC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.08
InChIKey:YZVYCRWDYYGBRC-UHFFFAOYSA-N
ID: 86093
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCC)cc1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -17.81
InChIKey:KVDBNLOKWYLSLD-UHFFFAOYSA-N
ID: 86094
SMILES:C1(O)(C)CCC2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 86095
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.331
CB1 binding score: -16.825
InChIKey:DEZOOYWMTLAASC-UHFFFAOYSA-N
ID: 86096
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 86097
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C(=O)O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N
ID: 86098
SMILES:C1C(C)C2C(C=C(C)C(C(c3c(O)cc(CCCCC)cc3)=O)OC2)CC(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -14.319
InChIKey:AYXWJAYOKLCUBU-UHFFFAOYSA-N
ID: 86099
SMILES:C(CCC)Cc1cc(O)c2c(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: 86100
SMILES:c1c(CCCCCC)cc2c(c1O)C1CC(C(O)(C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.057
InChIKey:CVTURLXRKPYEBK-UHFFFAOYSA-N