ID: 49582
SMILES:CC12CCC3C(Oc4c(c5c(cc(CCCC)cc5O)OC4(CO)C)O3)C1CCC(C(C)C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -15.092
InChIKey:MUKSEHITZTZLBN-UHFFFAOYSA-N
ID: 49583
SMILES:c1(C=O)c(CCCCC)cc2c(c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.972
InChIKey:XMFATGXZFZMSFO-UHFFFAOYSA-N
ID: 49584
SMILES:CC(C)(C(O)c1cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.488
InChIKey:FGUXQISXHCTFHO-UHFFFAOYSA-N
ID: 49585
SMILES:CC(CO)(c1c2cc(C)cc(O)c2c2c(c1)OC(C)(C)C1CCC(O)(C)C1C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.587
InChIKey:MMAYVNANVUGRMQ-UHFFFAOYSA-N
ID: 49586
SMILES:OC1C(C)(C)Oc2cc(CCCCC)c(O)c3c2C1CC(C)C3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.358
InChIKey:BLPSNWJWTNEELD-UHFFFAOYSA-N
ID: 49587
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)CC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.936
InChIKey:VOXDBJOUHMBAOR-UHFFFAOYSA-N
ID: 49588
SMILES:C1CC(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.186
InChIKey:JNZZREXYRLIYDU-UHFFFAOYSA-N
ID: 49589
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.427
InChIKey:UTXVBEHMQGNODO-UHFFFAOYSA-N
ID: 49590
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 49591
SMILES:C(c1c(C=O)c(O)c(CC=C(C)C)c(O)c1)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.793
InChIKey:XBLQUOHXRGWQBB-UHFFFAOYSA-N
ID: 49592
SMILES:c1(CO)c(CCCCC)cc2c(c1O)C1C(C3C=C(C)CCC1C(C)(C)O3)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.906
InChIKey:ONXSJZKOEFOPPZ-UHFFFAOYSA-N
ID: 49593
SMILES:C1OC(C=CC(C)(O)C)C2=CC3=C(C=C(C)C2=O)OC(C)(C)C2=CC132
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -16.218
InChIKey:ISHZEUGCSHYKBJ-UHFFFAOYSA-N
ID: 49594
SMILES:CC1=C2CC3C(C)(CC=CC4(C)OC143)Oc1c(c(O)cc(C(C)C(C)C)c1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -16.502
InChIKey:XRRXTMNMLSSAEZ-UHFFFAOYSA-N
ID: 49595
SMILES:CC1=CC2=C(C(C)(C)Oc3cc(CCC)cc(O)c32)CC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -14.518
InChIKey:XQLLWOONGXCKEG-UHFFFAOYSA-N
ID: 49596
SMILES:O1c2c(c(O)cc(C(O)C)c2)C2CCC3=CC(=O)C4C(C)(C)OC3(CC12C)C4C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -12.715
InChIKey:IEZAGIJKTHUXNI-UHFFFAOYSA-N
ID: 49597
SMILES:C1C(CCC=C(C)C)(C)Oc2c(c(O)cc(CCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.961
InChIKey:XNJZGZKQILOBLQ-UHFFFAOYSA-N
ID: 49598
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O)C3(O)C(C=C(C)C3=CC1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.519
CB1 binding score: -14.933
InChIKey:UFFPNABPENEEGS-UHFFFAOYSA-N
ID: 49599
SMILES:C12C(C(CNCc3ccc(Cl)cc3)C)CCC3(C)C1c1c(cc(CCCCC)cc1O)OC2(C)C=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.146
CB1 binding score: -15.358
InChIKey:VBYDQDWGVALXEA-UHFFFAOYSA-N
ID: 49600
SMILES:C1(C)=CC(c2ccc(CCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.46
CB1 binding score: -18.171
InChIKey:QBUIJIADVGCWQN-UHFFFAOYSA-N
ID: 49601
SMILES:C(CCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1C=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.8
InChIKey:RAYRUJHFLUVASM-UHFFFAOYSA-N
ID: 49602
SMILES:Cc1c(S(=O)(=O)O)c(CCCCC)cc2c1C1C(C(C)(C)O2)CC(=O)C(C)=1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.517
CB1 binding score: -15.526
InChIKey:FXZPZWBXODUMFD-UHFFFAOYSA-N