ID: 57373
SMILES:C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 57374
SMILES:C12C(CCC(C)=C1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.438
InChIKey:CBEWCUWSPDDHMI-UHFFFAOYSA-N
ID: 57375
SMILES:c1(O)cc(CCC)ccc1C1(CO)CCC(O)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.391
CB1 binding score: -15.275
InChIKey:YUDIFLVOSAIDEJ-UHFFFAOYSA-N
ID: 57376
SMILES:C1(C)=CCC2C(C)(C)Oc3c(c(O)c(C(CC(C)C)=O)c(O)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.53
InChIKey:NROYKMSGPAXRQS-UHFFFAOYSA-N
ID: 57377
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 57378
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(OC(C)=O)c3C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 57379
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCC)cc2O)CC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.888
InChIKey:XRVSXBLYAUVVFC-UHFFFAOYSA-N
ID: 57380
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.851
InChIKey:QFCHZSZOHXGORW-UHFFFAOYSA-N
ID: 57381
SMILES:C(CCc1cc(O)cc2c1OC(C)(C)C1OC12)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -12.17
InChIKey:BLOGKFAINPBRIT-UHFFFAOYSA-N
ID: 57382
SMILES:CC1=CCC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.15
InChIKey:FXRYFSBEEDYORZ-UHFFFAOYSA-N
ID: 57383
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(CC3C(C)(O)CCC4C(=C)C(=O)OC431)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 412.526
CB1 binding score: -13.407
InChIKey:KGPCHGCECNRZIY-UHFFFAOYSA-N
ID: 57384
SMILES:C(C)(C1CCC(C)=CCCC(C)=CCc2c(O)cc(CCCCC)cc2O1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.065
InChIKey:NAXGTLRUVSLFTF-UHFFFAOYSA-N
ID: 57385
SMILES:OC(=O)c1c(CCCCC)cc2c3c1OC(C)(C)C1CCC(C)(C21)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.93
InChIKey:YHNWJTOVFGPTAQ-UHFFFAOYSA-N
ID: 57386
SMILES:C1(C)=CCC(C(=C)C)C(c2c(O)cc(C)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.334
InChIKey:OCTQIDRSDSFRBW-UHFFFAOYSA-N
ID: 57387
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.404
InChIKey:VDAMXDQEAGSUAY-UHFFFAOYSA-N
ID: 57388
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 57389
SMILES:Oc1c(C=O)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 57390
SMILES:CCC(C(C)C)c1c(O)c2c(c(O)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.782
InChIKey:GOIVWGPMFIDPES-UHFFFAOYSA-N
ID: 57391
SMILES:Oc1cc(O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 57392
SMILES:c1(C(CC)CCC)c(O)cc2c(c1)OC(C)(C)C1C2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.287
InChIKey:GCQPCWYSABVSPS-UHFFFAOYSA-N
ID: 57393
SMILES:C1CC2(C)Oc3cc(O)c(O)cc3C3C2C2(C)C(C(O)C=CC(C)(C)OC(=O)c4ccccc4)CCC12C(C)=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.688
CB1 binding score: -17.494
InChIKey:HHLIZCGRBLIZNS-UHFFFAOYSA-N