ID: 81712
SMILES:C(C)CCCc1cc2c(c(O)c1C=O)CC1C(C)(O2)C=CC(C(C)(C)OC)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.655
InChIKey:WZUWFWVVMGGBMM-UHFFFAOYSA-N
ID: 81713
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c(C(=O)CC(C)C)c(O)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.385
InChIKey:KCKFCLWTUCSIQS-UHFFFAOYSA-N
ID: 81714
SMILES:CC1=CC(c2c(O)cc(-c3ccc(C)cc3)cc2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.459
CB1 binding score: -16.307
InChIKey:BBINOZROCFCGOR-UHFFFAOYSA-N
ID: 81715
SMILES:c1(O)cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.139
InChIKey:ZQEQEZRRDUREAY-UHFFFAOYSA-N
ID: 81716
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCC)cc2)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -15.741
InChIKey:XWMANLQKRVDWEQ-UHFFFAOYSA-N
ID: 81717
SMILES:C1C(C)(C)C(CCC(C)=CCOc2ccc3c(c2O)OC(C)(CCC=C(C)C)C=C3)(C)CC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.717
CB1 binding score: -15.87
InChIKey:LPQZEWNOFZBOLM-UHFFFAOYSA-N
ID: 81718
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(C)c3)C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 81719
SMILES:Oc1c2c(c(C)c(C(=O)CC(C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.45
InChIKey:NWZQXMXXOSHNNH-UHFFFAOYSA-N
ID: 81720
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 81721
SMILES:C(C)(CC)Cc1c(O)c(C(=O)C2C(C(C)=C)CCCC2C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.714
InChIKey:NUUGZIPKNBTTKM-UHFFFAOYSA-N
ID: 81722
SMILES:O=C(C)OCC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(OCC3OCCO3)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -15.374
InChIKey:HYZIAJNYZZJRNB-UHFFFAOYSA-N
ID: 81723
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)OC(C)(C#CCC(C)=C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.502
InChIKey:RSSJMCIVMJLLDO-UHFFFAOYSA-N
ID: 81724
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 81725
SMILES:O(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1)C1CC(C)CCC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.722
CB1 binding score: -15.913
InChIKey:VDYRKWMEOXQKBQ-UHFFFAOYSA-N
ID: 81726
SMILES:Oc1c2c(c(C(=O)C(CC)C)cc1)OC(C)(C)C1CCC(C)=CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.621
InChIKey:UFACJPCVFLIBIR-UHFFFAOYSA-N
ID: 81727
SMILES:CC1=CC2c3c(cc(CCCCC)cc3OC(=O)C)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 81728
SMILES:OC12Cc3c(O)cc(CCCCC)cc3OC1(C)CC=C(C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.929
InChIKey:XTEOUWVCTKPODS-UHFFFAOYSA-N
ID: 81729
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(C(O)CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.303
InChIKey:JDQJZJYSRXMMOP-UHFFFAOYSA-N
ID: 81730
SMILES:C12(c3c(cc(CCCCC)cc3)OC1OCC)C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.886
InChIKey:HFVDPRVHAOSLHP-UHFFFAOYSA-N
ID: 81731
SMILES:C1(=C)C(=O)OC2CC(COC(=O)C)=CCCC3(C)C(O)CC(C)(c4c(OC(=O)C)cc(CCCCC)cc4O3)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 568.707
CB1 binding score: -15.397
InChIKey:CHPZUEVLUUZOLL-UHFFFAOYSA-N
ID: 81732
SMILES:c1(CCc2cc(OC)c(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c2)cc(O)cc(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -13.016
InChIKey:NERGCIBRHPNANX-UHFFFAOYSA-N