ID: 62035
SMILES:C1C2C(C)(C)C1CC(C(C)=C)(O)C1c3c(cc(CCCCC)c(C(OC)=O)c3O)OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -16.282
InChIKey:VQJRONSTFQRIPG-UHFFFAOYSA-N
ID: 62036
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 62037
SMILES:CCCCc1cc(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.779
InChIKey:VXMYRUJLTHSFQU-UHFFFAOYSA-N
ID: 62038
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O1)C2CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.015
InChIKey:OHWZMHARJUSWIC-UHFFFAOYSA-N
ID: 62039
SMILES:C1CCC(C)(C)C(C)(c2cc(CCCCC)ccc2OC)C1=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.567
CB1 binding score: -14.738
InChIKey:NVDXPKVROQZFSJ-UHFFFAOYSA-N
ID: 62040
SMILES:C1(C)(C)CCCC2(C)C1=CC=C1C2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.333
InChIKey:KNXGTRJBHARDFJ-UHFFFAOYSA-N
ID: 62041
SMILES:CC(=C)C1CC(C(=C)C)C(c2c(OC)ccc(CCN(C)C)c2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 381.604
CB1 binding score: -13.644
InChIKey:RFGKXWYGUFCZHN-UHFFFAOYSA-N
ID: 62042
SMILES:CC1(C)Oc2c(c(O)cc(Cc3cc(O)ccc3)c2)C2C1CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.257
InChIKey:MLDFSWRAVXUBBY-UHFFFAOYSA-N
ID: 62043
SMILES:COc1c2c(c3c(c1)C(O)C(=O)C(C)C3)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -11.158
InChIKey:CQQRIWQYPNRHIE-UHFFFAOYSA-N
ID: 62044
SMILES:C(C)CCCCC(OCc1cc(O)c2c(c1)OC(C)(C)c1c(O)cc(C)cc1-2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -13.58
InChIKey:CUEGSBQZTJUWTP-UHFFFAOYSA-N
ID: 62045
SMILES:C(C)(=C)C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 62046
SMILES:CC(C)=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 62047
SMILES:C1CC(C)=CC(c2c(O)ccc(CCC(O)C)c2)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.647
InChIKey:LVKYGAKMNNBBCK-UHFFFAOYSA-N
ID: 62048
SMILES:CC1(C)C2C3C(C)(Oc4cc(CCCCC)cc(O)c42)CCC1C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.229
InChIKey:CUUAJTYSUKHVQS-UHFFFAOYSA-N
ID: 62049
SMILES:c1c(CCCCCC)cc2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.267
InChIKey:QTCHRXDBRGDNFN-UHFFFAOYSA-N
ID: 62050
SMILES:C(C)(C)C(=CCc1c(O)cc(C)c(O)c1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.901
InChIKey:LHRTVTCROBZBQI-UHFFFAOYSA-N
ID: 62051
SMILES:Oc1c2c(c(CC(CC=C(C)C)C(O)(C)C)c(O)c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -15.01
InChIKey:CVJGCJHWFRMELL-UHFFFAOYSA-N
ID: 62052
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 62053
SMILES:CCCCCCc1cc2c(c(O)c1)C1(O)C(CC(C(C)C)=C1C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.768
InChIKey:ALBMMUBDJNRKRM-UHFFFAOYSA-N
ID: 62054
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -17.87
InChIKey:MWSJWVPKFNKHGK-UHFFFAOYSA-N
ID: 62055
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(OC(=O)C)c(OC)cc3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.109
InChIKey:WGAXIFFEWGVMCU-UHFFFAOYSA-N