ID: 56176
SMILES:Oc1c2c(cc(CCCCC)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: 56177
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 56178
SMILES:C(Cc1cc2c(c(O)c1)C1(O)CC(CC=C(CCC=C(C)C)C)(C)C(O)C(O)=C1O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.034
InChIKey:OZTBUORRBKUSTR-UHFFFAOYSA-N
ID: 56179
SMILES:CC1(C)Oc2cc(CO)cc(O)c2CC(CCCC(COC(=O)C)C)(C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.214
InChIKey:QBNHZQGYHDCGLQ-UHFFFAOYSA-N
ID: 56180
SMILES:CC1=CC2(OO)OC(=C(C)C(=O)c3c(O)cc(CCCCC)cc32)C1OC(C(CC1CC2OC2(C)C1CC=C(C)C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 594.745
CB1 binding score: -15.547
InChIKey:NNRWDZAIMLJKQQ-UHFFFAOYSA-N
ID: 56181
SMILES:CC1(C)C=CCC2(C)Oc3c(c(O)cc(CCCCC)c3OC)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16
InChIKey:GOHGPBZBJVLPEN-UHFFFAOYSA-N
ID: 56182
SMILES:C1(CO)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 56183
SMILES:C(c1cc(C=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC21)COC=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -12.217
InChIKey:JBROYANGEYLWAL-UHFFFAOYSA-N
ID: 56184
SMILES:C(CCC(=CCOc1c(C(OC)=O)c(O)cc(CCCCC)c1)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.358
InChIKey:SKHZAHDNBIDCEY-UHFFFAOYSA-N
ID: 56185
SMILES:c1c(O)c(CCCCC)cc2c1OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.077
InChIKey:NGFPAXCHIPIMOG-UHFFFAOYSA-N
ID: 56186
SMILES:c1(CCCC(O)C)cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.443
InChIKey:CBSNPBZLNSMFIA-UHFFFAOYSA-N
ID: 56187
SMILES:O(c1cc2c(cc1C(O)(C)C)OC(C)(C)C1C2CC(C)(O)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.151
InChIKey:FMTYWKGGWWXCET-UHFFFAOYSA-N
ID: 56188
SMILES:c1(-c2c(O)cc(CCCCC)cc2O)cc2c(c(O)c1)CC(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.171
InChIKey:UGHLTMYFEBOGTR-UHFFFAOYSA-N
ID: 56189
SMILES:C1(c2cc3c(cc2O)C=CC(C)(CCC=C(C)CO)O3)CC(C)(C)OC(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.74
InChIKey:BOZKTAALTKOTGY-UHFFFAOYSA-N
ID: 56190
SMILES:C1CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C(C)CCC123
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.949
InChIKey:PPZFVCDTTJSIKX-UHFFFAOYSA-N
ID: 56191
SMILES:C1(C)(C)Oc2cc(CCC)ccc2C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -16.254
InChIKey:BDGLGASQIKBRGA-UHFFFAOYSA-N
ID: 56192
SMILES:CC(C)C(Cc1c2c(ccc1C)OC(C)(C)C1C2CC(C)=CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.813
InChIKey:OTAAFAQTPAHECM-UHFFFAOYSA-N
ID: 56193
SMILES:C(CC)=CCc1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -11.081
InChIKey:LQDNGDQIZMDVMU-UHFFFAOYSA-N
ID: 56194
SMILES:c1(O)c(C(=O)C(C)C)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 56195
SMILES:c12cc(CCCCC)cc(OC3CCC(C)(C=C)O3)c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -17.334
InChIKey:FAHYTDQIOPOVHV-UHFFFAOYSA-N
ID: 56196
SMILES:C(C)c1cc(O)c2c(c1C(=O)OC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -11.892
InChIKey:GMGXNPYUXKOPJS-UHFFFAOYSA-N