ID: 43828
SMILES:Cc1cc(O)c2c3c1OC(C)(C)C2CCC(C)=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -14.478
InChIKey:ONEZQTMDSINRLT-UHFFFAOYSA-N
ID: 43829
SMILES:C1CC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)c(C(=O)O)c3c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.913
InChIKey:YMRFFOGMNMTVGW-UHFFFAOYSA-N
ID: 43830
SMILES:C1C2(C)C(Cc3c(c4c(cc3OC)C(c3ccccc3)=O)OC(C)(C)C3C(C4)C(C)(C)O2)C(=O)C(OC)(C1)C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.73
CB1 binding score: -14.99
InChIKey:XOOJUTFSLYGFQA-UHFFFAOYSA-N
ID: 43831
SMILES:C1C(C)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 43832
SMILES:C(=CC(C)C(=C)C)Oc1c2c(ccc1)C1=C(C(C)(C)O2)CCC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -14.58
InChIKey:FLZMCCVVWIHBER-UHFFFAOYSA-N
ID: 43833
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 43834
SMILES:O1c2c(cc(C)c(CCC(CC(O)=O)C)c2)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -12.757
InChIKey:UCZOTMUDXMPIBR-UHFFFAOYSA-N
ID: 43835
SMILES:C1(C)CC(=O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.29
InChIKey:ZKWVZNXNFDETGF-UHFFFAOYSA-N
ID: 43836
SMILES:C(CCCC)Cc1cc(O)c2c(c1)C1C(CCC(COC)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.245
InChIKey:GLFPPVCRCDCNCC-UHFFFAOYSA-N
ID: 43837
SMILES:C1(CCC(OC)=O)C(C)(C)Oc2cc(C)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.321
CB1 binding score: -17.34
InChIKey:TYTIHHSPAZQFFJ-UHFFFAOYSA-N
ID: 43838
SMILES:C=C(C1Cc2c(cc(CCCCC)cc2O)OC1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.918
InChIKey:HPCCWPQTTVIPBN-UHFFFAOYSA-N
ID: 43839
SMILES:C1(C)C=C(C)OC2C3C(C)=CCC13c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.963
InChIKey:NMKOZNNHNKKTGU-UHFFFAOYSA-N
ID: 43840
SMILES:C(CCCCCCCCCC)CCc1cc2c(c(OC)c1)C1=C(C(C)(C)O2)CCC(O)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.71
CB1 binding score: -17.037
InChIKey:JLMNOTJEDNHHHV-UHFFFAOYSA-N
ID: 43841
SMILES:C12C(c3c(O)cc(CCCC)cc3OC1(C)CC=CC(C)(C)O)C(CO)CC1=C2C(C)CCC1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.759
CB1 binding score: -16.533
InChIKey:SEUXOBFMCBTSGR-UHFFFAOYSA-N
ID: 43842
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCC)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 43843
SMILES:CCCC(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -17.61
InChIKey:RRSOJODSSKABLV-UHFFFAOYSA-N
ID: 43844
SMILES:c1(CCCCC)cc2c(c(O)c1C(OC)=O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.307
InChIKey:CVKXPIFTHMEWGP-UHFFFAOYSA-N
ID: 43845
SMILES:O1C(C)(CCC=C(C)C)C2C3C1c1c(cc(CC=C)cc1O)OC3(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: Not available
InChIKey:FLVJCMATRYZLIR-UHFFFAOYSA-N
ID: 43846
SMILES:c12cc(C)cc(O)c1C(C)(C)Oc1cc(CCCCC)cc(OC)c1C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -16.164
InChIKey:ZCCRVCJQCOULSB-UHFFFAOYSA-N
ID: 43847
SMILES:OCC1=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: 43848
SMILES:c1(O)cc2c(c(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N