ID: 30850
SMILES:OC1C(C(C)C)C2C(C(C)Oc3c2c(O)cc(CCCCC)c3)C=C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.116
InChIKey:CEKSNPCTNYZLPF-UHFFFAOYSA-N
ID: 30851
SMILES:Oc1c(Cc2cc(O)c(C3C(C(C)=C)CCC3(C)CCCC(O)(C)C)c(O)c2)cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.304
InChIKey:AZSWTQPLRYLXQO-UHFFFAOYSA-N
ID: 30852
SMILES:CC1CC2c3c(cc(CC=C)cc3O)OC(CO)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.557
InChIKey:YBIIJANWTZFCOQ-UHFFFAOYSA-N
ID: 30853
SMILES:C(CCCCCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.869
InChIKey:FESUGQWHGPXRME-UHFFFAOYSA-N
ID: 30854
SMILES:Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -19.64
InChIKey:YDNWBFSIBJMVMP-UHFFFAOYSA-N
ID: 30855
SMILES:CC1(C)C2CCC(C)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.521
InChIKey:MIFAHFHUDCQEMR-UHFFFAOYSA-N
ID: 30856
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 30857
SMILES:c1(O)c(CCCC)c(O)c2c(c1)OC(C)(C)C1C2C=C(C(OC)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: Not available
InChIKey:GRHMBFNJUANWPS-UHFFFAOYSA-N
ID: 30858
SMILES:C(C1=C(C)OC(C(O)C)(C)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 224.344
CB1 binding score: -14.99
InChIKey:MMWXRJAEOLJSCZ-UHFFFAOYSA-N
ID: 30859
SMILES:O1CC12C13C(CCC(C)C1CO)Oc1c(c(O)cc(C)c1)C3OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.445
InChIKey:YZSSDUFVJSCSRE-UHFFFAOYSA-N
ID: 30860
SMILES:CC(CC(CC(C)C)=O)=CCc1c2c(cc3c1CC1C(O)OC(=O)C13)OC(C1C(C)(C)O1)(C(C)(C)O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.643
CB1 binding score: -14.845
InChIKey:PKEKFANEJKGIIJ-UHFFFAOYSA-N
ID: 30861
SMILES:C(CC(C(Cl)c1cc(O)c2c(c1)OC1(C)CC2C(C)(C)C(Br)CC1)C)(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 471.907
CB1 binding score: -16.123
InChIKey:WSGJVQMSCABVFL-UHFFFAOYSA-N
ID: 30862
SMILES:C12c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 30863
SMILES:C(CCC)(c1cc(OCC2(C)C3CCC(C)=CC3c3c(c(CCCNC(=O)C)c(O)cc3C)O2)c[nH]1)N
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 509.691
CB1 binding score: -14.254
InChIKey:GJKNVKFHRDSOKR-UHFFFAOYSA-N
ID: 30864
SMILES:C(C1=C(c2ccccc2)c2c(c(O)c(CC=C(C)C)c(O)c2)C2C(C(C)(C)Oc3c(C)c(CCCCC)cc(O)c32)C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 582.781
CB1 binding score: -16.302
InChIKey:DOSRNFDZYDSOKJ-UHFFFAOYSA-N
ID: 30865
SMILES:C(C1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)=CCC12)=CC=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.236
InChIKey:ZKXHBZJQHKBDPL-UHFFFAOYSA-N
ID: 30866
SMILES:CC1(C)C2CC2c2c(cc(CCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.264
InChIKey:HZRZOWVUCBCVBJ-UHFFFAOYSA-N
ID: 30867
SMILES:c1(CCCCC)cc2c(c(O)c1)C=CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 30868
SMILES:CCOc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC=C(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -15
InChIKey:FPZCFWKZDCSPLH-UHFFFAOYSA-N
ID: 30869
SMILES:c1(CCCCC)cc2c3c(c1)OC(C)(C)C1CC(O)C(C=O)(O)CC1C3O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.841
InChIKey:OKVFAOTZNFOXPS-UHFFFAOYSA-N
ID: 30870
SMILES:C1=C2C3(CC3(C)C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16
InChIKey:QKQVAHIFPJUMIE-UHFFFAOYSA-N