ID: 64870
SMILES:O=C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C(C(C)CC1)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.341
InChIKey:AFRJANIXODGPJL-UHFFFAOYSA-N
ID: 64871
SMILES:C1C(=C)C2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.748
InChIKey:ZXEMYVXEDUTETJ-UHFFFAOYSA-N
ID: 64872
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1(O)C(O)CC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.754
InChIKey:FFXHOQVWBQGPTB-UHFFFAOYSA-N
ID: 64873
SMILES:C1(CO)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.153
InChIKey:FHFWMWLGGRCLAF-UHFFFAOYSA-N
ID: 64874
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC=CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -13.756
InChIKey:GULCCGTXXHMKQW-UHFFFAOYSA-N
ID: 64875
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 64876
SMILES:C(CN)Cc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 303.446
CB1 binding score: -14.296
InChIKey:ZFDMPCOYNNWEPQ-UHFFFAOYSA-N
ID: 64877
SMILES:C(CC)Cc1cc(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.1
InChIKey:IGHPHANYGIPSNW-UHFFFAOYSA-N
ID: 64878
SMILES:CC(OC1CC2(C)C(C(CO)(O)CCC2)C2c3c(O)cc(CCCCC)cc3OC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -15.716
InChIKey:WJXAJKRLSLUUFS-UHFFFAOYSA-N
ID: 64879
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.388
InChIKey:SPQILLGTJLAJPN-UHFFFAOYSA-N
ID: 64880
SMILES:O1c2c(cc(O)c(C)c2)C(CCC(O)C)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -16.365
InChIKey:BEIXPOTZAWUWBV-UHFFFAOYSA-N
ID: 64881
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1(C(C)=CC(C(O)C(C)(C)O)O1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.429
InChIKey:ZFXNQZNWASOXJS-UHFFFAOYSA-N
ID: 64882
SMILES:C1(C)(C)C2C(C)(C3(c4c(O)cc(CCC)cc4O2)Oc2cc(O)ccc2C3=O)CCC=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.532
CB1 binding score: -16.675
InChIKey:HILXMTMFRCCJSJ-UHFFFAOYSA-N
ID: 64883
SMILES:c1(CCCCC)cc2c(cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.041
InChIKey:UMOQSYCBNIIJKH-UHFFFAOYSA-N
ID: 64884
SMILES:C=C1C2C(O)(CC3(C)CC(c4c(O)cc(C(O)CCCC)cc4O3)C1=O)C(C)CC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.196
InChIKey:GOABIRXDWIZODI-UHFFFAOYSA-N
ID: 64885
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)=CCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.026
InChIKey:XMTGBPSDIFMOCF-UHFFFAOYSA-N
ID: 64886
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(CC(=O)C=C(C)C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.036
InChIKey:OHXUHPWZARCROX-UHFFFAOYSA-N
ID: 64887
SMILES:CC12C=CC(=O)C(C)(C)C1C(OC(=O)C)CC1C2CC(c2c(O)cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -13.43
InChIKey:CUPVCIJIOKDODA-UHFFFAOYSA-N
ID: 64888
SMILES:C1CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.141
InChIKey:OJRKFOLLPFUYIA-UHFFFAOYSA-N
ID: 64889
SMILES:C1CC2C(C)CCC3C(C)(C)Oc4c(c(O)cc(CCCCC)c4)C3C2C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -14.254
InChIKey:KDMVBJNUAAMCGO-UHFFFAOYSA-N
ID: 64890
SMILES:C1(C(=C)C)=CC2(C(C)CC1)Cc1c(c(C(OC)=O)c(CCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.663
InChIKey:RRYSWQFKFCROCE-UHFFFAOYSA-N