ID: 54055
SMILES:Cc1cc(O)c(C2C3C(C(C)(O)CC2)C3)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.868
InChIKey:LXWWRSUIEXBZSM-UHFFFAOYSA-N
ID: 54056
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -19.278
InChIKey:LPBNLDPLKUJIEG-UHFFFAOYSA-N
ID: 54057
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(O)C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.898
InChIKey:SUVXTOCRTNYFMQ-UHFFFAOYSA-N
ID: 54058
SMILES:C1C2C(C)(C)Oc3c(c(OC)cc(C)c3C2OC)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.531
InChIKey:BWPACEPLRNWRRH-UHFFFAOYSA-N
ID: 54059
SMILES:C(=CCCC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O)(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 54060
SMILES:O=C(OCC1(C)Cc2c(c3c(cc2)-c2c(c(O)cc(CCCCC)c2)OC3)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -13.675
InChIKey:KCTTVGWUFCZXJY-UHFFFAOYSA-N
ID: 54061
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 54062
SMILES:C12C(C)(Oc3c(c(O)cc(CCCCC)c3)C1O)CCC(O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.547
InChIKey:MYQNMJUHQRHGKG-UHFFFAOYSA-N
ID: 54063
SMILES:OCC(O)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.822
InChIKey:LXZNWSXGBXYVBB-UHFFFAOYSA-N
ID: 54064
SMILES:C1=C(C)CCC(C(CCC=C(C)C)(C)O)C1c1c(O)cc(CC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.023
InChIKey:USQQTPAPRTUCRN-UHFFFAOYSA-N
ID: 54065
SMILES:C(C)(=CCCC1(C)Oc2cc(CCCC)c(O)c(O)c2CC1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.676
InChIKey:YRAAIKPJGBXYSM-UHFFFAOYSA-N
ID: 54066
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(O)(C)CCC1C(C)=C)C(O)C(C)(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -13.832
InChIKey:KLTZYCJDWVLTFM-UHFFFAOYSA-N
ID: 54067
SMILES:C1(=C)C2C(C(C)(C)Oc3cc(C)c(C(=O)O)c(O)c32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -16.96
InChIKey:IDLPNGWAPKMIJS-UHFFFAOYSA-N
ID: 54068
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 54069
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(C)CCC1(C(=O)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.387
InChIKey:VEWFUHSPZPNWNE-UHFFFAOYSA-N
ID: 54070
SMILES:c1(CCCCC)cc(C2C(C(=C)C)CCC(C)=C2)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.107
InChIKey:AKCTZOKCVCWTGX-UHFFFAOYSA-N
ID: 54071
SMILES:C(c1oc2c(c(=O)c1)C1C=C(C)CCC1C(C)(C)O2)C(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.007
InChIKey:LDWJCBHQTOAIMQ-UHFFFAOYSA-N
ID: 54072
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.171
InChIKey:HFDMGJLGHZDMNB-UHFFFAOYSA-N
ID: 54073
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1CCC(COC(C)=O)(O)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.308
InChIKey:BHNMAYWQIRTPHD-UHFFFAOYSA-N
ID: 54074
SMILES:C(C(O)(C(C)C)CCc1c2c(ccc1O)OC(C)(C)C1C(C(C)CC1)C2)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -15.379
InChIKey:FBDAFXHFGSJHCH-UHFFFAOYSA-N
ID: 54075
SMILES:C(CCC)Cc1c2c(c(O)c(CC=C(C)C)c1OC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: Not available
InChIKey:GGLQFJUKNJKCBI-UHFFFAOYSA-N