ID: 44143
SMILES:C(CCCC(CCCC(C)C)C)(O)(CC(=O)Oc1cc(CC(=O)O)cc2c1OC(C)(C)C1CCC(C(=O)O)=CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.739
CB1 binding score: -13.49
InChIKey:LBJNVMBEAQVIPS-UHFFFAOYSA-N
ID: 44144
SMILES:C1(=C)C2C(C(C)(C)Oc3c(c(O)cc(CCC)c3)C2O)C(O)CC1C(C=C(CCC=C(C)C)C)OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.714
CB1 binding score: -13.565
InChIKey:MZQPKNORFBGFOS-UHFFFAOYSA-N
ID: 44145
SMILES:CC(C)(O)C=CCC1(C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.81
InChIKey:SZYKXWKCBRZDMT-UHFFFAOYSA-N
ID: 44146
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 44147
SMILES:c1(Cl)c2c(c(O)cc1Cl)C1CC(C)C(O)CC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 331.239
CB1 binding score: -14.534
InChIKey:IHIZZSHAKODSQQ-UHFFFAOYSA-N
ID: 44148
SMILES:c1(C2C=C(C)CCC2C(C)=C)c(O)cccc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.764
InChIKey:VCTOYXGKNMVKJN-UHFFFAOYSA-N
ID: 44149
SMILES:c1c(O)c2c(cc1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.056
InChIKey:BASZVWQQTWCPJX-UHFFFAOYSA-N
ID: 44150
SMILES:C1C(Cc2c(O)c(C(=O)O)c(CCCCC)cc2O)=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -9.882
InChIKey:GGKDBFQFWLHUQI-UHFFFAOYSA-N
ID: 44151
SMILES:C(O)c1ccc2c(c1CCC=O)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.814
InChIKey:PMUJRWHBKNEPLK-UHFFFAOYSA-N
ID: 44152
SMILES:c1(C)c(C(=O)OCC=C)c(C=O)c(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -16.339
InChIKey:RKVLSYSELRSGRL-UHFFFAOYSA-N
ID: 44153
SMILES:C(C1=CCC(=C(C)CCC=C(C)C)CC1)OC(CC(=CCc1c(O)c(C)cc(OC)c1)CC=CCC)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -15.555
InChIKey:LSZNQKSPTKQSFB-UHFFFAOYSA-N
ID: 44154
SMILES:CC1(C)C2C1c1c(cc(CCCCC)cc1O)OC2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.737
InChIKey:HJABRBNMTDKKKL-UHFFFAOYSA-N
ID: 44155
SMILES:C1(O)(C)CC2=C(c3c(cc(CCCCC)cc3O)OC2)C(O)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: Not available
InChIKey:QSNHGZOXIPXFPH-UHFFFAOYSA-N
ID: 44156
SMILES:Oc1c2c(cc(C(C)C=CC=CC)c1OC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.103
InChIKey:BUZWBVDXJHNKMO-UHFFFAOYSA-N
ID: 44157
SMILES:C(CCCCC)CCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -16.333
InChIKey:BXEIWKZPIQXQEP-UHFFFAOYSA-N
ID: 44158
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 44159
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)C)=CC3=C(C=CC=CC3=O)OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.577
CB1 binding score: -17.088
InChIKey:LUDZABXLQVUVEP-UHFFFAOYSA-N
ID: 44160
SMILES:c1(O)c2c(cc(C(C)C(C3CCC4C(C)(C)OC4(C)C)c3)c1)OCO2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.929
InChIKey:GSQRAOACTFWJHT-UHFFFAOYSA-N
ID: 44161
SMILES:CC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 44162
SMILES:C(C)(CCC=C(C)C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 44163
SMILES:Oc1cc(CCCC)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.879
InChIKey:IXZUQKJFDLWXNQ-UHFFFAOYSA-N