ID: 114199
SMILES:O(c1c(O)c(OC)c(C2C=C(C)CC(c3c(O)cc(CCCCC)cc3O)C2CC=C(C)C)c(O)c1)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: -13.967
InChIKey:XMMOXTAOIPVHFN-UHFFFAOYSA-N
ID: 114200
SMILES:C12(C)CC(O)C(C)=CC1(c1c(O)cc(C(CC(CCCCCCCN)C)O)cc1O)CC(C)(O)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 503.724
CB1 binding score: -15.246
InChIKey:JNIVMSGDKRETRA-UHFFFAOYSA-N
ID: 114201
SMILES:CC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 114202
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(=CC=CC(C)(O)C)COC1=O)C(C)C2)c1ccc(OC)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -15.287
InChIKey:YYUSTNSZLKGHSH-UHFFFAOYSA-N
ID: 114203
SMILES:OCC(=CCCC(=CCc1c(O)cc(CCCCC)cc1OC)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -18.197
InChIKey:ZTNJWVHQBLNABH-UHFFFAOYSA-N
ID: 114204
SMILES:C1=C(C)CCC(O)(C(C)=C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.529
InChIKey:BAXRZDQZNCZXGK-UHFFFAOYSA-N
ID: 114205
SMILES:C1(O)CC(C)C2C3=C(C(C)C)C=CC(C)(Oc4cc(CCCC)cc(O)c41)C32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.166
InChIKey:LQKRNUXSTNSFKQ-UHFFFAOYSA-N
ID: 114206
SMILES:C(O)(Cc1ccc(C2C(C(=C)C)CCC(C)=C2)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.14
InChIKey:JBWLJUVVPHHFJD-UHFFFAOYSA-N
ID: 114207
SMILES:Oc1cc(CCCCC)cc(O)c1C1=C(C)C(=O)OC(C)(C)C1CCC(C)(O)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.406
InChIKey:CRHOUUMTDZMDTR-UHFFFAOYSA-N
ID: 114208
SMILES:CCCCCc1cc(O)c2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.943
InChIKey:AQFXVBGXHOAFAM-UHFFFAOYSA-N
ID: 114209
SMILES:C1C(C(=C)C)C(c2c(O)cc(O)cc2C(C)(C)CCC=C(C)C)C(O)C(O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -13.926
InChIKey:OZFLBXVCFMEAHQ-UHFFFAOYSA-N
ID: 114210
SMILES:c1(O)cc(O)cc(C)c1C1C(C(C)=C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.153
InChIKey:PLSKWGHPZLRFEE-UHFFFAOYSA-N
ID: 114211
SMILES:O1c2c(c(O)cc(CCCCC)c2)C=CC(C)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.933
InChIKey:RQSRPQZMNCIBIO-UHFFFAOYSA-N
ID: 114212
SMILES:c1(O)c(C(CC2=C(C)CCCC2(C)C)=O)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.217
InChIKey:MFWSLDHOVIVAHE-UHFFFAOYSA-N
ID: 114213
SMILES:O(C)C(=O)C12CCC(C)=CC1c1c(cc(CCCCC)cc1O)OC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -12.896
InChIKey:HVDQSDGKANMDEH-UHFFFAOYSA-N
ID: 114214
SMILES:C1(=C(C)C)CCC2(C)C(Cc3c(cc(CCCCC)c(C=O)c3O)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.689
InChIKey:UPTFCDFPIAELJB-UHFFFAOYSA-N
ID: 114215
SMILES:CC(C1C(c2c(O)cc(C)cc2O)CC(C)=CC1)C=C(C=C(C)C)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -18.329
InChIKey:TYNUENNHGORBKA-UHFFFAOYSA-N
ID: 114216
SMILES:CC(C(C)c1c(C(=O)O)cc(CCCCC)cc1O)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.38
InChIKey:RBNUNWDIQWJXHL-UHFFFAOYSA-N
ID: 114217
SMILES:c1(CC(C)C)cc2c(c(O)c1)C1CC(C(=C)C)C=CC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.12
InChIKey:PWXMBYRNOOIUOB-UHFFFAOYSA-N
ID: 114218
SMILES:C(C1CCC(CO)=CC1c1c(O)cc(CCCCC)cc1O)(CC(C)(O)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -15.239
InChIKey:FOCWJZSOLNAMTE-UHFFFAOYSA-N
ID: 114219
SMILES:c1cc(OS(C)=O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.427
CB1 binding score: -15.929
InChIKey:VVSOGAZOKSDMFV-UHFFFAOYSA-N