ID: 72157
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 72158
SMILES:CCCCCc1c(C(=O)O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 72159
SMILES:c1(O)ccc(C2Oc3c(c(O)cc(CCCCC)c3)CC2=C(C)C)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -14.029
InChIKey:YPCJAJTXXLVOKO-UHFFFAOYSA-N
ID: 72160
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 72161
SMILES:C=C1CC2C3(C1)C(O)OCC3CC1(C)C2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -12.969
InChIKey:YSTYWYHNTYYEBL-UHFFFAOYSA-N
ID: 72162
SMILES:O=C(c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC12)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.306
InChIKey:URTQUOJTCDTXHV-UHFFFAOYSA-N
ID: 72163
SMILES:CC1(C)CC(=O)C(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.365
InChIKey:XXGQKUOUWBYZKX-UHFFFAOYSA-N
ID: 72164
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)c1ccc(O)c(C=O)c1-2)CC=C(CO)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.456
CB1 binding score: -14.397
InChIKey:UKMASIZLQNTEKC-UHFFFAOYSA-N
ID: 72165
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(CCC=C(C)C)(C)CCC1(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.605
CB1 binding score: -9.483
InChIKey:FDDAOMCNILBQCS-UHFFFAOYSA-N
ID: 72166
SMILES:c12c(ccc3c(C)cccc13)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.497
CB1 binding score: -17.448
InChIKey:FLRAMOGXUMHLQC-UHFFFAOYSA-N
ID: 72167
SMILES:C1CC(C)(OC(=O)C)C(OC)CC(C(=C)C)C1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.823
InChIKey:USLHYHREZVQLSC-UHFFFAOYSA-N
ID: 72168
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 72169
SMILES:C(CC(C(Cl)c1[nH]c2c(c1)CC1=C3C(C=C2)C(C(C)=C)CCC3(C)O1)CCC)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.114
CB1 binding score: -15.116
InChIKey:VMRKKJTWUZVGHB-UHFFFAOYSA-N
ID: 72170
SMILES:c1(CCCCC)cc(O)c(CC=C(C)CC=CC(C)=C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.249
InChIKey:ZSGQBNMIBMJDBC-UHFFFAOYSA-N
ID: 72171
SMILES:c12c(c(O)cc(CCCCC)c1)C(=O)C(=O)C1C(C)(C2)OC(C)(C)C2CCC(C)(O)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -16.382
InChIKey:HNQOGOFIIOTNBP-UHFFFAOYSA-N
ID: 72172
SMILES:CC1(C)Oc2ccc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 204.313
CB1 binding score: -18.596
InChIKey:OFJSFHKUFJUKPC-UHFFFAOYSA-N
ID: 72173
SMILES:CC1(CCC(OC(C)=O)C(C)=C)c2c(O)cc(C)cc2OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.221
InChIKey:FXXZVZQZPWXWQG-UHFFFAOYSA-N
ID: 72174
SMILES:C(Cc1c(CCCCC)cc(O)c2c1OC1CC(C)=CCC1(C)CCC=C(C)C2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -13.075
InChIKey:VSRJNOZJFHKMMC-UHFFFAOYSA-N
ID: 72175
SMILES:C(CCCC)c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.433
InChIKey:PQJHNORQVFURSH-UHFFFAOYSA-N
ID: 72176
SMILES:CC(CC=CC(C)(C)OC)C1CCC(C)(Oc2cc(CCCCC)cc(O)c2O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.645
CB1 binding score: -16.399
InChIKey:QBRPQOYEWCQLBT-UHFFFAOYSA-N
ID: 72177
SMILES:C(=CC(=CCOc1c2c(cc(CCCCC)c1)OC(C)(C)C1O2)C=C(C)CC1)C(OC)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -17.023
InChIKey:MTTFRWBAKBPGRF-UHFFFAOYSA-N