ID: 95929
SMILES:Oc1cc(C2(COC(C(C)C)=O)c3c(cc(C)cc3O)OC2(C)C)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -18.264
InChIKey:OLPBKOLCSUERMD-UHFFFAOYSA-N
ID: 95930
SMILES:C(C1C(C)(C)Oc2cc(CCC)cc(O)c2C1)CC=C(C)CCCC(C(OC)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.912
InChIKey:SJPWXDANLFCLFA-UHFFFAOYSA-N
ID: 95931
SMILES:C(C)(=CC1CC2(C)Oc3c(c(O)c(C(=O)O)c(CCCCC)c3)C2C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.014
InChIKey:JTCKPPGVQBYOGC-UHFFFAOYSA-N
ID: 95932
SMILES:CC12CC3c4c(cc(CCCCC)cc4OC(C)=O)OC1OC(C)(C)C2CCC3=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -13.645
InChIKey:VBVRTXOZSIAJGO-UHFFFAOYSA-N
ID: 95933
SMILES:c1c2c(cc(CCCC)c1)OC(C(C=CC=C(C)C)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -15.116
InChIKey:AAZILQLMXGTELA-UHFFFAOYSA-N
ID: 95934
SMILES:C1(=O)C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -17.248
InChIKey:XJSLLVRPOMMKKS-UHFFFAOYSA-N
ID: 95935
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 95936
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(C(CC)(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.967
InChIKey:WPOKWOQDARZHEG-UHFFFAOYSA-N
ID: 95937
SMILES:C1C(C)(O)C2C3C1c1c(O)cc(CCCCC)cc1OC3(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.128
InChIKey:FOJUUNRTFZJLNR-UHFFFAOYSA-N
ID: 95938
SMILES:C1c2c(cc(CCCCC)c(C(=O)O)c2O)OC(C)(C)C2CCC(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.608
InChIKey:RMYSKDHJTMJIHU-UHFFFAOYSA-N
ID: 95939
SMILES:CCCCCc1c(C2C=C(C)CCC2C(C)=C)c(O)c(C=O)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.51
InChIKey:HVHGQLIPGTXIKX-UHFFFAOYSA-N
ID: 95940
SMILES:CC1CCC(C(C)(C)CO)C2C(C1)c1c(cc(C)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.754
InChIKey:VEDOJGLIYCYNGU-UHFFFAOYSA-N
ID: 95941
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C3C(CC(C=O)=C3)C2(C(=O)O)CC1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -11.515
InChIKey:HNWNKRJKYCVKQS-UHFFFAOYSA-N
ID: 95942
SMILES:C1(C)c2c(c(O)c3c(c2O)C=CC(C)(C)O3)OC(C)(C)C1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.461
InChIKey:MMOQQQSTSFDUTQ-UHFFFAOYSA-N
ID: 95943
SMILES:c1c2c(cc(C)c1)-c1c(cc(CCCCC)cc1O)OC2(COC(CCCCCCC)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -16.726
InChIKey:SOTOWFCPXUQBBR-UHFFFAOYSA-N
ID: 95944
SMILES:CC(=CCc1c(O)cc(C(O)=O)c(CCCCC)c1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.334
InChIKey:IBMAVYDRRHOYLE-UHFFFAOYSA-N
ID: 95945
SMILES:Cc1c2c(cc(O)c1)C13C(C(CCC(O)(C)C)(C1)O3)C(C)(C)OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -13.604
InChIKey:WGNJLBULWGMSOZ-UHFFFAOYSA-N
ID: 95946
SMILES:c1c(O)ccc2c1C1=C(C(C)(C)OC(C)(C)C(O)C1)C=CC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.479
InChIKey:SQCADZLBEKDFNX-UHFFFAOYSA-N
ID: 95947
SMILES:c1(CCCCC)cc(OC)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 95948
SMILES:C(CCCCCC=Cc1c(CCCCC)cc2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2)=CCC=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.772
CB1 binding score: -16.297
InChIKey:IFNXFHDICAVFJQ-UHFFFAOYSA-N
ID: 95949
SMILES:CCCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N