ID: 119617
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)C1=CC=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.519
InChIKey:IEDBPHGMLBHEAY-UHFFFAOYSA-N
ID: 119618
SMILES:C12C(CC(=O)C1C)C(C)(C)Oc1c2c(O)cc(C(C)=O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -16.952
InChIKey:WWISVPZHNNPKJZ-UHFFFAOYSA-N
ID: 119619
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C(O)C(C)(O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.803
InChIKey:JXJDJXGETBHMTD-UHFFFAOYSA-N
ID: 119620
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 119621
SMILES:C1C(C(=C)C)C(c2cc(CCCC)ccc2OC)C(C(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -13.985
InChIKey:BPSABUHBKGFNEB-UHFFFAOYSA-N
ID: 119622
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 119623
SMILES:CC1=CC(c2c(O)cc(CCC)cc2O)CC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.443
InChIKey:SKFXBWLZONYOTE-UHFFFAOYSA-N
ID: 119624
SMILES:C1CC(C(=C)C)C(c2c(C)cc(O)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 119625
SMILES:C(Cc1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1O)=CC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.502
InChIKey:ALHGODVDFRLBON-UHFFFAOYSA-N
ID: 119626
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 119627
SMILES:C1(c2c(O)cc(CCCCC)cc2OC)C(C(C)C)CCC2(C)OC2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.381
InChIKey:DRFOKLFHFPOLCP-UHFFFAOYSA-N
ID: 119628
SMILES:OC12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.313
InChIKey:XIIAOXXFRJHRGJ-UHFFFAOYSA-N
ID: 119629
SMILES:C1=C(C2C(C(C)=C)CCC(C)=C2)C(=O)C(CC)C(=O)S1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.428
CB1 binding score: -15.149
InChIKey:DQGHWLMOFFMSIZ-UHFFFAOYSA-N
ID: 119630
SMILES:c1c(CCCC)cc2c(c1CC=C(C)C)OC(C)(C)C1C2Cc2c1cc(O)c(C)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -15.395
InChIKey:HEMIZOHIIDBOPM-UHFFFAOYSA-N
ID: 119631
SMILES:O=c1cc(CCCCC)cc2c(c1O)C1CC(C(C)=C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.358
InChIKey:VWCQPIUAZCLFGH-UHFFFAOYSA-N
ID: 119632
SMILES:C1(C)(C)C(O)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.147
InChIKey:LTTDKOQPYODETD-UHFFFAOYSA-N
ID: 119633
SMILES:c12c(c(O)cc(CCCCC)c1)CC1C(C)(CCCC1(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 119634
SMILES:C1C(C)=CC(c2c(O)c(CC=C(C)C)cc(CCc3cc(O)c(CC=C(CCC=C(C)C)C)c(O)c3)c2)(O)C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.787
CB1 binding score: -15.174
InChIKey:SIOCUSWBBHJITQ-UHFFFAOYSA-N
ID: 119635
SMILES:C(CCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.131
InChIKey:BXAPCJBJZCNUQB-UHFFFAOYSA-N
ID: 119636
SMILES:Oc1cc(C)cc(O)c1C1CC(=C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.868
InChIKey:JGZSDZXNHSKGNP-UHFFFAOYSA-N
ID: 119637
SMILES:C1CC(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.844
InChIKey:PWPQLXXOFXROSJ-UHFFFAOYSA-N