ID: 40720
SMILES:C(CCCCCC)Cc1cc2c(c(O)c1)C1C(O)C(CO)(O)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -15.437
InChIKey:MBWZNNPWURFSRP-UHFFFAOYSA-N
ID: 40721
SMILES:C12=C(CC=CC1C)C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -14.79
InChIKey:IAHZCVXQXRFKMA-UHFFFAOYSA-N
ID: 40722
SMILES:C1(C)=CC2c3cc(ccc3O)OC(C)(C)C(OC(=O)C)CC=C(C)C(CC1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -15.193
InChIKey:XIDLZPKXAZZAKJ-UHFFFAOYSA-N
ID: 40723
SMILES:C1C(C)C23C(c4c(OC)cc(CCCCC)cc4O2)C(C(C)=C)CCC3(C)C(OC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -16.425
InChIKey:KXXLIWRGTNCJCX-UHFFFAOYSA-N
ID: 40724
SMILES:C1(C)(C)C=Cc2c(O)cc(CCC)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 40725
SMILES:CC1=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 40726
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2OC)C2C(C)(O)CCC2C(C)(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -13.068
InChIKey:BBQLXEQSRJXAMQ-UHFFFAOYSA-N
ID: 40727
SMILES:O=C(CC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.831
InChIKey:RAIFOXASCJJAPP-UHFFFAOYSA-N
ID: 40728
SMILES:c12c(ccc(CCCCC)c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.987
InChIKey:RMWYCANPNUTKIT-UHFFFAOYSA-N
ID: 40729
SMILES:C(CC(C)CCCC1(C)Oc2c3c(cc(O)c2CC1O)C(=O)CC(OC)C3O)c1ccccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -13.528
InChIKey:VJSBTXXUFIQMCP-UHFFFAOYSA-N
ID: 40730
SMILES:C12C(C)(C3C(C)(Oc4c(c5c(c(O)c4)C2CC3)CC(C)C5=O)C)CC(=O)C(O)=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.51
CB1 binding score: -15.374
InChIKey:YCSKOYKZPJKXGR-UHFFFAOYSA-N
ID: 40731
SMILES:C1(=O)C(C(C)C)C(c2c(O)cc(CCCCC)cc2)C2C(C)(O2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.368
InChIKey:DFOQLVFLSKFXEX-UHFFFAOYSA-N
ID: 40732
SMILES:CC1(CCC=C(C)C)CC(c2cc(O)ccc2OC)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: Not available
InChIKey:FRRDFEJAGLIMFK-UHFFFAOYSA-N
ID: 40733
SMILES:C(C1C2c3c(CC=C(C)C)cc(C(=O)O)cc3OC(C)(C)C(CC1)O2)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.881
InChIKey:QCRFTPOQGYVVCE-UHFFFAOYSA-N
ID: 40734
SMILES:C(Cc1cc(O)c(C(OC)=O)c(CCCCC)c1)=C(Cc1cc(C2CC(C(C)=C)CCC2(C)CCCC(CC=CC(=C)C)C)cc(O)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 685.002
CB1 binding score: -15.866
InChIKey:FKYWETGIVDWCDR-UHFFFAOYSA-N
ID: 40735
SMILES:c12c(cc(C)cc1O)OC(CCCCCC)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -16.527
InChIKey:MSUUIKKHZAQOJM-UHFFFAOYSA-N
ID: 40736
SMILES:C(C=C)CCc1cc2c(c(O)c1)C1C3(O)C(C)(O2)CCC(C(=C)C)CC13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.806
InChIKey:VXCHYCVFPGBDMZ-UHFFFAOYSA-N
ID: 40737
SMILES:C1(CO)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.509
InChIKey:NNXBAMUSBWFVKT-UHFFFAOYSA-N
ID: 40738
SMILES:C1(=C)CC2C(C(C)(C)Oc3c(c(O)cc(CCC)c3)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.498
InChIKey:RGTPSNYWVZNNOU-UHFFFAOYSA-N
ID: 40739
SMILES:O=C(c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC2=C(C)CCC3C(C)(C)C3C21C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -13.537
InChIKey:YKNZYGDRZQESDF-UHFFFAOYSA-N
ID: 40740
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C(=O)C2=C1CCC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -14.314
InChIKey:RKYLYWRKSKASKS-UHFFFAOYSA-N